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CHEBI:18397 - 2-phenylethylamine

ChEBI IDCHEBI:18397
ChEBI Name2-phenylethylamine
Stars
DefinitionA phenylethylamine having the phenyl substituent at the 2-position.
Secondary ChEBI IDsCHEBI:8063, CHEBI:14782, CHEBI:25965
Last Modified15 January 2021
DownloadsMolfile

FormulaC8H11N
Net Charge0
Average Mass121.183
Monoisotopic Mass121.08915
SMILESNCCc1ccccc1
InChIInChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2
InChIKeyBHHGXPLMPWCGHP-UHFFFAOYSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification

ChEBI Ontology
IUPAC Name 
2-phenylethanamine
Synonyms  Source
PhenethylamineKEGG COMPOUND
2-PhenylethylamineKEGG COMPOUND
beta-PhenylethylamineKEGG COMPOUND
PhenylethylamineKEGG COMPOUND
β-aminoethylbenzeneNIST Chemistry WebBook
β-phenethylamineNIST Chemistry WebBook
Manual XrefsDatabases
C05332KEGG COMPOUND
C05332KEGG COMPOUND
DB04325DrugBank
2-phenylethylamineWikipedia
HMDB0012275HMDB
PEAPDBeChem
C00001426KNApSAcK
ECMDB02654ECMDB
Registry NumbersSources
Gmelin:50120Gmelin
Reaxys:507488Reaxys
CAS:64-04-0KEGG COMPOUND
CAS:64-04-0ChemIDplus
CAS:64-04-0NIST Chemistry WebBook
Citations