THR C Chemical Shift Outliers

Average chemical shift: 174.572
Standard deviation: 1.697

Low-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
40271C180.61
4193191C180.21
4321115C180.881
4388146C179.961
440516C181.391
466490C179.861
477536C179.741
483323C181.581
48335C181.431
568435C183.81
5822100C181.331
582261C180.771
5823179C180.771
5823218C181.331
58922C181.6511
589268C180.1461
5897121C182.08801
589724C181.23401
5946148C180.1981
6015115C181.0721
601587C179.6801
602484C182.0151
60582C179.701
607426C180.2131
6229171C180.181
623673C180.1001
624919C181.8901
6249208C181.8901
6249222C181.8901
628583C181.11
629526C179.9541
63425C180.3751
635784C181.9561
6434143C180.8681
643441C180.8441
6468125C181.261
646893C184.4311
66425C180.0271
667916C180.4461
667918C181.2411
667944C182.411
667951C179.9551
667953C181.6851
672214C180.7621
678774C180.981
7003170C181.3411
7003205C179.9461
712281C180.11
723684C181.9731
723784C182.0371
723884C182.0711
723984C182.1391
1004817C179.9101
1515211C185.3271
1515231C181.5471
1515267C181.6501
1535225C180.0001
1540420C180.2041
1540464C181.9401
1540466C181.2341
15422109C180.01
1573679C180.7631
1574679C180.7081
157577C179.81
1578896C180.931
1591790C181.9161
1594913C183.717
1594922C185.208
1594929C181.668
1594943C182.353
1594944C185.918
1594952C183.665
1594955C180.717
1594956C180.185
15969128C181.531
160069C179.8201
1603328C180.2271
1605082C181.011
1610965C180.0781
1620510C179.8131
1626343C179.902
163728C182.9651
1639817C179.6661
16439107C181.2731
1643941C179.9591
1646570C180.361
1659884C181.9201
1667385C181.3871
16729307C180.3011
1678183C180.331
1689970C180.5921
1698210C181.2521
16982111C180.9431
16982226C181.0231
16982244C181.4131
1701711C179.8191
17085100C181.0001
1708594C181.2311
1714462C180.41
1714662C180.31
1723131C181.941
1726092C179.8091
17265107C181.5321
1726533C180.7611
1737835C180.0711
1737838C181.0981
173787C182.4751
17404193C179.731
17404198C179.841
17404202C179.901
1740486C179.931
17428138C180.69301
17447109C180.8071
1747979C181.0651
1757431C180.5571
1760326C180.2591
17647110C180.8701
1771088C180.0131
17738187C180.0641
17781202C180.9541
17781210C180.1291
17781255C179.9691
1778134C179.9821
1778159C180.3861
177816C180.7981
1780570C180.5921
17827100C180.1641
1783953C180.9871
1802991C179.71
1814261C180.5601
1829619C180.8541
1829641C182.3431
1829669C180.4031
1829675C181.5781
1829682C181.1551
1829687C181.8821
1839588C180.0131
1840493C180.581
1849388C180.0131
18504124C180.3231
1852021C182.231
1852024C182.341
1885475C179.9711
1885662C179.886
1886843C180.4031
1886875C179.9711
1892272C181.730
1902868C181.4191
1905523C181.76131
1908778C181.68361
1914352C179.70001
19208277C180.3001
1924213C181.60001
1924313C181.60001
1924513C181.30001
1933965C180.6411
1942561C180.3251
1955315C180.1921
1955348C180.2511
1995335C180.0711
1995338C181.0981
199537C182.4751
1997680C181.6421
25157124C180.4821
25157125C181.5781
25157160C180.4841
25157162C179.981
25157163C180.7241
2515739C180.1431
2515741C179.7281
2524333C182.772
25266128C181.30001
2526646C179.70001
2526651C180.00001
252669C180.20001
2551046C179.9471
2564851C181.9511
2572940C180.1111
2583088C181.2731
2592311C180.434
26044160C182.7991
26044172C180.3941
26044178C180.6411
26044180C180.2371
26044185C182.7791
260445C180.2321
260446C180.7171
2631414C180.4321
2631488C180.731
2659376C183.71
2661717C179.9291
26651101C179.7511
26664102C180.321
26733103C179.8391
26782175C180.9791
26787112C180.2691
2678791C179.9881
27191141C181.75371
27284120C180.604
2735264C179.7451
2739532C180.801
2757168C182.117
2805737C180.1431
3009164C180.8732
3009222C179.7849
3009243C181.377
30102114C180.052
3085426C181.3111
3103467C181.081
3458567C181.0031
3477128C179.7021
3607521C179.81
3634527C180.5051
50000240C180.18321
5001541C185.3191
5021093C179.8371
5042235C181.287
507941C179.7921
50845114C180.0001
5084545C179.7831
5084558C180.0631
5088760C180.1471
5094556C184.7651
50960125C180.319
5106345C180.4201
5112642C182.6361
5130455C179.69
5130459C179.67
51810106C184.376

High-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
425982C165.51
425988C168.61
466824C169.3751
49445C167.171
5222110C168.81
5267142C169.101
5514108C168.791
551438C167.221
551449C168.271
551459C166.161
551463C168.741
562355C168.3021
581355C169.1791
592951C168.91
611121C169.311
611167C169.011
611186C168.711
611186C169.191
634839C169.0
6586101C167.9241
658644C169.1151
65868C167.9561
673011C128.373
673018C132.591
673027C130.380
673029C128.938
673032C131.323
673055C128.691
673061C129.794
673091C128.488
673095C130.167
678376C169.321
688257C169.4251
7182105C61.784
718783C167.8711
718785C169.4781
722072C169.3701
730759C169.31
730859C169.21
7313207C169.11
731377C168.91
735189C168.8701
735191C166.9201
11001142C168.91
1100196C168.31
1101816C169.151
1112572C168.7881
1114027C168.6931
1123638C168.7521
1123644C169.0041
151283C169.2161
15164422C168.7291
1519027C166.8981
15426153C169.083
15514218C169.4051
1555872C168.7001
15680106C168.8181
1570166C169.061
1572269C167.2781
1572312C166.9811
1572343C168.7671
15912102C168.211
1591216C169.071
1591216C169.151
1595628C168.371
1595671C169.251
1611979C166.3521
1620410C166.6321
1651860C169.2
165589C169.0861
165599C169.1131
1662113C168.5031
1668448C169.0172697470001
1671275C169.1131
1671375C169.1381
1677133C66.961
16809100C165.681
1680916C169.071
1680916C169.151
1680941C168.531
1680943C167.861
168095C168.711
1680966C168.171
1687499C169.3491
16948137C169.4301
16984156C167.5061
17109101C12.0691
17109107C13.5481
17109118C13.1691
17109120C12.7351
17109121C14.1451
17109142C15.1871
1710951C14.5911
1710952C17.0601
1710953C16.0851
1710960C11.8471
171098C13.9611
1710981C14.2211
1710990C12.8231
1710992C12.4641
171538C168.41
171548C169.41
171568C168.31
1745652C169.1421
1745679C169.2311
1747772C168.7001
180318C169.1231
1810857C169.2561
1820469C169.3221
182926C168.9081
18388139C167.7061
18389139C168.0861
1850954C168.6561
1865247C168.281
1870854C168.6561
18730175C168.131
1873091C169.031
192289C169.301
19239146C168.8191
1923955C168.8821
1948612C168.9101
1955356C168.4001
19560138C166.701
19560170C168.261
1983412C169.440
2504810C168.581
2504855C167.901
25379101C169.121
25379134C168.5231
25379137C168.3581
25379139C169.0451
25379154C165.3631
2537970C165.7711
2567929C4.780
2568129C9.917
2569326C169.4221
2569328C169.0271
2576080C169.369
2580310C169.4471
267172C168.41
26717226C169.41
2672033C168.7391
2674183C168.055
2674283C168.11
26848100C168.7811
26848125C169.1921
26848204C168.0191
26851100C168.8081
26851125C169.1311
26851204C168.0051
2697319C168.8921
26996120C168.09
2699654C169.43
27019114C168.991
2701982C169.480
27078215C169.41
2724646C169.329
2724746C169.28
2727144C168.9441
2744531C168.9911
2756218C168.853
27588313C169.4631
27589313C168.7871
27590161C169.3091
27590313C168.9711
2759173C169.3581
27592129C168.4501
2759227C169.4461
2763791C169.3421
27691246C169.3181
2770719C72.9361
2770746C71.0371
277075C69.7011
2770752C70.3791
2770770C69.4831
2770779C68.7141
2770794C70.7531
2770798C72.1861
2783423C169.1971
27859193C168.1
27859200C169.2
2810952C168.4231
281099C169.1121
3000742C169.4341
30537104C169.11
305727C169.11
30604153C168.948
308252C169.4061
34088154C169.3171
34088154C169.4341
3419429C167.2711
3453171C168.3351
3478524C166.6721
3478532C166.0921
3478537C168.31
5033475C169.0951
5068018C169.211
5074365C169.1801
5134795C87.7805
5138034C167.736
5141965C168.7731
5141987C169.4001
5151593C169.25
51533168C168.5251
51810188C59.71
51810215C8.111
5208726C169.3631