8-Butoxybenzo[a]pyrene

SpectraBase Compound ID	DrSvqiHWdCy
InChI	InChI=1S/C24H20O/c1-2-3-13-25-20-10-12-21-19(15-20)14-18-8-7-16-5-4-6-17-9-11-22(21)24(18)23(16)17/h4-12,14-15H,2-3,13H2,1H3
InChIKey	JSBCYUGRTKGPSR-UHFFFAOYSA-N Google Search
Mol Weight	324.42 g/mol
Molecular Formula	C24H20O
Exact Mass	324.151415 g/mol

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SpectraBase Spectrum ID	CGaLNnyNRxJ
Name	8-Butoxybenzo[a]pyrene
Alternate Name(s)	8-Butoxybenzo[def]chrysene benzo[def]chrysen-8-yl butyl ether
CAS Registry Number	78673-06-0
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H20O
InChI	InChI=1S/C24H20O/c1-2-3-13-25-20-10-12-21-19(15-20)14-18-8-7-16-5-4-6-17-9-11-22(21)24(18)23(16)17/h4-12,14-15H,2-3,13H2,1H3
InChIKey	JSBCYUGRTKGPSR-UHFFFAOYSA-N
Molecular Weight	324.423 g/mol
SMILES	c12c3c4ccc(cc4cc2ccc2c1c(cc3)ccc2)OCCCC
SPLASH	splash10-00kr-0091000000-58d07ecc5577fa2b4b78
Source of Spectrum	J-46-4160-0
Wiley ID	1323761