7-oxo-7,8,9,10-tetrahydrobenzo[a]pyrene-10-carboxylic acid, methyl ester

SpectraBase Compound ID	LKXGIgDKJC1
InChI	InChI=1S/C22H16O3/c1-25-22(24)16-9-10-18(23)17-11-14-6-5-12-3-2-4-13-7-8-15(21(16)17)20(14)19(12)13/h2-8,11,16H,9-10H2,1H3
InChIKey	JIDKQUOJEZHZPQ-UHFFFAOYSA-N Google Search
Mol Weight	328.37 g/mol
Molecular Formula	C22H16O3
Exact Mass	328.109944 g/mol

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SpectraBase Spectrum ID	FgAXGZTW0We
Name	7-OXO-7,8,9,10-TETRAHYDROBENZO[a]PYRENE-10-CARBOXYLIC ACID, METHYL ESTER
Source of Sample	G. H. Daub, University of New Mexico, Albuquerque, New Mexico
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H16O3
InChI	InChI=1S/C22H16O3/c1-25-22(24)16-9-10-18(23)17-11-14-6-5-12-3-2-4-13-7-8-15(21(16)17)20(14)19(12)13/h2-8,11,16H,9-10H2,1H3
InChIKey	JIDKQUOJEZHZPQ-UHFFFAOYSA-N
Literature Reference	J. ORG. CHEM. 48, 3577(1983) Abstract-Chemical Abstracts= 99, 139464S(1983)
Molecular Weight	328.367004
Synonyms	BENZO/A/PYRENE-10-CARBOXYLIC ACID, 7-OXO-7,8,9,10-TETRAHYDRO-, METHYL ESTER
Technique	KBr WAFER