Dataset

ETHYL CINNAMATE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP009455 contains the MS mass spectrum of ETHYL CINNAMATE with the InChIkey KBEBGUQPQBELIU-CMDGGOBGSA-N.

Chemical Information

molecular Image

InChI	InChI=1S/C11H12O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+
SMILES	CCOC(=O)C=Cc(c1)cccc1
InChI Key	KBEBGUQPQBELIU-CMDGGOBGSA-N
Molecular Formula	C11H12O2
Exact Mass	176.084 g/mol

Data and Resources

ETHYL CINNAMATEHTML

Go to source

Related Molecule ⌄

ethyl (E)-3-phenylprop-2-enoate

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-JP009455
Version
Author
Maintainer
Language
MetadataPublished	2016-01-19
Related Molecule	ethyl (E)-3-phenylprop-2-enoate

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CHEBI:4895	chebi
CHEMBL318196	chembl
112445	surechembl
637758	pubchem
C023P3M5JJ	fdasrs
PD158441	probes_and_drugs
BIDMOQ	CCDC
107401	brenda
140064	brenda
Molport-001-779-802	molport
The data in this table is sourced from UniChem at EBI.