Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C19H18O2/c20-19(21)12-11-18-13-16-6-5-14-1-3-15(4-2-14)7-9-17(18)10-8-16/h1-4,8,10-13H,5-7,9H2,(H,20,21)/b12-11+
SMILES	OC(=O)/C=C/c1cc2ccc1CCc1ccc(CC2)cc1
InChI Key	RCZUOZBAQDBPCG-VAWYXSNFSA-N
Molecular Formula	C19H18O2
Exact Mass	278.345 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/RCZUOZBAQDBPCG-VAWYXSNFSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/RCZUOZBAQDBPCG-VAWYXSNFSA-N/CHMO0000470
Version
Author	Yichuan Wang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T08:01:26.746094
MetadataModified	2024-09-07T23:54:10.354349
MetadataPublished	2022-12-03

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
166001327	PubChem
The data in this table is sourced from UniChem at EBI.