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CHEBI:87417 - 2-phenylethyl formate
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ChEBI Name
2-phenylethyl formate
ChEBI ID
CHEBI:87417
Definition
A formate ester of 2-phenylethanol.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C9H10O2
Net Charge
0
Average Mass
150.17450
Monoisotopic Mass
150.06808
InChI
InChI=1S/C9H10O2/c10-8-11-7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2
InChIKey
IKDIJXDZEYHZSD-UHFFFAOYSA-N
SMILES
O=COCCc1ccccc1
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2-phenylethyl formate (
CHEBI:87417
)
has functional parent
2-phenylethanol (
CHEBI:49000
)
2-phenylethyl formate (
CHEBI:87417
)
has role
metabolite (
CHEBI:25212
)
2-phenylethyl formate (
CHEBI:87417
)
is a
formate ester (
CHEBI:52343
)
IUPAC Name
2-phenylethyl formate
Synonyms
Sources
2-Phenethyl methanoate
ChemIDplus
Benzylcarbinyl formate
ChemIDplus
Benzylcarbinyl methanoate
ChemIDplus
β-phenethyl formate
NIST Chemistry WebBook
formic acid phenethyl ester
ChEBI
Manual Xref
Database
HMDB0040428
HMDB
View more database links
Registry Numbers
Types
Sources
104-62-1
CAS Registry Number
ChemIDplus
104-62-1
CAS Registry Number
NIST Chemistry WebBook
2044524
Reaxys Registry Number
Reaxys
Last Modified
28 August 2015