Phenethylamine
Phenethylamine synonyms
2-Amino-fenylethan [Czech]; 2-phenylethylamine; .beta.-Phenylaethylamin; Benzeneethanamine; 2-phenylethanamine; 1-Amino-2-phenylethane; Delphinic acid; Ethanamine, 2-phenyl-; PHENETHYLAMINE, BETA; .beta.-Phenethylamine hydrochloride; .beta.-Phenylathylaminhydrochlorid
Graphical representations:
View large 3D structure
Molecular Formula: C8H11N
Natural Isotopic Abundance Mass: 121.17964
Mono-Isotopic Molecular Masses:
- C12N14: 121.0891493583
- C13N14: 129.1159880607
- C12N15: 122.0861842515
- C13N15: 130.1130229539
InChI string: InChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2
PubChem Compound (CID): 1001CAS Registry number: 71750-39-5 503-74-2 156-28-5 5471-08-9 64-04-0
Sigma-Aldrich: 241008_ALDRICH
ChEBI: CHEBI:18397
HSDB: 3526
ChemIDplus: 000064040
ChemSpider: 13886660
EINECS: 200-574-4
NMRShiftDB: 20032292
DTP/NCI: 10811
CambridgeSoft Corporation: 7773
KEGG Compound ID: C05332
Beilstein Handbook Reference: 4-12-00-02453
ChemDB: 4260836
NIST Chemistry WebBook: 1237233126
MMCD: cq_02975
MDL: MFCD00008184
PDB Compound ID: PEA
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)