Dataset

YASHABUSHIKETOL; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP010370 contains the MS mass spectrum of YASHABUSHIKETOL with the InChIkey OUAINJWTDRNZIJ-ACCUITESSA-N.

Chemical Information

molecular Image

InChI	InChI=1S/C19H20O2/c20-18(13-11-16-7-3-1-4-8-16)15-19(21)14-12-17-9-5-2-6-10-17/h1-11,13,19,21H,12,14-15H2/b13-11+
SMILES	OC(CCc(c2)cccc2)CC(=O)C=Cc(c1)cccc1
InChI Key	OUAINJWTDRNZIJ-ACCUITESSA-N
Molecular Formula	C19H20O2
Exact Mass	280.146 g/mol

Data and Resources

YASHABUSHIKETOLHTML

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Related Molecule ⌄

(E)-5-hydroxy-1,7-diphenylhept-1-en-3-one

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-JP010370
Version
Author
Maintainer
Language
MetadataPublished	2016-01-19
Related Molecule	(E)-5-hydroxy-1,7-diphenylhept-1-en-3-one

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
11208265	PubChem
16290565	PubChem: Thomson Pharma
192664	ChEBI
70018916	NMRShiftDB
25721903	eMolecules
MCULE-3361967539	Mcule
J1.666.635A	Nikkaji
The data in this table is sourced from UniChem at EBI.