Dataset

METHYL 3-PHENYLPROPIONATE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP009771 contains the MS mass spectrum of METHYL 3-PHENYLPROPIONATE with the InChIkey RPUSRLKKXPQSGP-UHFFFAOYSA-N.

Chemical Information

molecular Image

InChI	InChI=1S/C10H12O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
SMILES	COC(=O)CCc(c1)cccc1
InChI Key	RPUSRLKKXPQSGP-UHFFFAOYSA-N
Molecular Formula	C10H12O2
Exact Mass	164.084 g/mol

Data and Resources

METHYL 3-PHENYLPROPIONATEHTML

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Related Molecule ⌄

methyl 3-phenylpropanoate

Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP009771
Version
Author
Maintainer
Language
MetadataPublished	2016-01-19
Related Molecule	methyl 3-phenylpropanoate

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CHEBI:89875	chebi
LMFA07010951	lipidmaps
CHEMBL2252087	chembl
168711	surechembl
7643	pubchem
111LC1GI10	fdasrs
PD158255	probes_and_drugs
HMDB0030060	hmdb
DTXSID2059271	comptox
Molport-002-040-582	molport
The data in this table is sourced from UniChem at EBI.