Molecular Formula: C14H30O2
Natural Isotopic Abundance Mass: 230.3868
Mono-Isotopic Molecular Masses:
- C12N14: 230.2245802072
- C13N14: 244.2715479364
- C12N15: 230.2245802072
- C13N15: 244.2715479364
InChI string: InChI=1S/C14H30O2/c1-2-3-4-5-6-7-8-9-10-11-13-16-14-12-15/h15H,2-14H2,1H3
PubChem Compound (CID):
24750 CAS Registry number: 9002-92-0
MMCD: cq_09312
CAS Registry number: 503027-85-8 8027-11-0 183117-57-9 86727-31-3 869893-21-0 1334-72-1 148498-91-3 942439-95-4 234761-83-2 384842-79-9 3055-99-0 53026-66-7 152206-24-1 147398-17-2 54351-54-1 9015-55-8 798544-27-1 6540-99-4 124401-71-4 87296-34-2 39316-02-4 56590-57-9 9002-92-0 71636-71-0 56093-86-8 348616-52-4 266678-04-0 101008-55-3 137736-73-3 64772-19-6 191546-41-5 39316-41-1 106254-08-4 14675-38-8 186762-97-0 176596-95-5 69344-85-0 106856-65-9 53241-34-2 777931-72-3 56939-70-9 37343-87-6 359786-16-6 1341-05-5 141875-75-4 221642-91-7 61373-94-2 201746-17-0 875119-83-8 86547-02-6 106254-09-5 62229-27-0 234764-37-5 57244-90-3 50815-86-6 504414-58-8 935753-05-2 234761-82-1 234761-81-0 9079-21-4 148093-10-1 51426-13-2 122779-58-2 55892-94-9 31798-98-8 101840-74-8 459409-03-1 362661-71-0 12789-47-8 55599-84-3 102329-60-2 54398-17-3 66048-74-6 102342-03-0 138100-08-0 50815-85-5 176235-62-4 11106-34-6 903524-77-6 61710-38-1 71932-08-6 189388-50-9 942929-81-9 37231-23-5 39363-77-4
EPA DSSTox: 31296
CCRIS: 3397
KEGG Compound ID:
D01993 HSDB: 4351
ChemIDplus: 009002920
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
InChI string and atom numbering calculated using ALATIS
(Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia,
"Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017),
doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)