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

SpectraBase Compound ID	JMj9UN7CcGE
InChI	InChI=1S/C23H18O3/c1-2-26-23(25)17-10-11-19(24)18-12-15-7-6-13-4-3-5-14-8-9-16(22(17)18)21(15)20(13)14/h3-9,12,17H,2,10-11H2,1H3
InChIKey	NIQFVLNGGUAJNY-UHFFFAOYSA-N Google Search
Mol Weight	342.39 g/mol
Molecular Formula	C23H18O3
Exact Mass	342.125594 g/mol

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SpectraBase Spectrum ID	HpcM7Su7O2c
Name	7-OXO-7,8,9,10-TETRAHYDROBENZO[a]PYRENE-10-CARBOXYLIC ACID, ETHYL ESTER
Source of Sample	G. H. Daub, University of New Mexico, Albuquerque, New Mexico
CAS Registry Number	86803-15-8
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H18O3
InChI	InChI=1S/C23H18O3/c1-2-26-23(25)17-10-11-19(24)18-12-15-7-6-13-4-3-5-14-8-9-16(22(17)18)21(15)20(13)14/h3-9,12,17H,2,10-11H2,1H3
InChIKey	NIQFVLNGGUAJNY-UHFFFAOYSA-N
Literature Reference	J. ORG. CHEM. 48, 3577(1983) Abstract-Chemical Abstracts= 99, 139464S(1983)
Melting Point	88.5-90C
Molecular Weight	342.394012
Synonyms	BENZO/A/PYRENE-10-CARBOXYLIC ACID, 7-OXO-7,8,9,10-TETRAHYDRO-, ETHYL ESTER
Technique	KBr WAFER