CHEBI:173825 - 2-Phenylethyl propanoate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-Phenylethyl propanoate
ChEBI ID CHEBI:173825
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H14O2
Net Charge 0
Average Mass 178.231
Monoisotopic Mass 178.09938
InChI InChI=1S/C11H14O2/c1-2-11(12)13-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
InChIKey HVGZQCSMLUDISR-UHFFFAOYSA-N
SMILES O(CCC1=CC=CC=C1)C(=O)CC
ChEBI Ontology
Outgoing 2-Phenylethyl propanoate (CHEBI:173825) is a benzenes (CHEBI:22712)
IUPAC Name
2-phenylethyl propanoate
Manual Xrefs Databases
8125 ChemSpider
HMDB0035013 HMDB
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Registry Number Type Source
122-70-3 CAS Registry Number ChemIDplus