Benzo[e]pyrene

SpectraBase Compound ID	FsCQNSJzzJA
InChI	InChI=1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H
InChIKey	TXVHTIQJNYSSKO-UHFFFAOYSA-N Google Search
Mol Weight	252.32 g/mol
Molecular Formula	C20H12
Exact Mass	252.0939 g/mol

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SpectraBase Spectrum ID	Gl5iO1pcGd1
Name	Benzo[e]pyrene
Alternate Name(s)	1,2-Benzopyrene 1,2-Benzpyrene 4,5-Benzopyrene 4,5-Benzpyrene 9,10-Benzpyrene B(e)P Benz(e)pyrene Benzo(l)pyrene BRN 1911334 CCRIS 786 EINECS 205-892-7 HSDB 4031 NSC 89273
CAS Registry Number	192-97-2
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H12
InChI	InChI=1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H
InChIKey	TXVHTIQJNYSSKO-UHFFFAOYSA-N
Molecular Weight	252.316 g/mol
SMILES	c12c3c4cccc3ccc1cccc2c1c4cccc1
SPLASH	splash10-0udi-0090000000-dc172d490cb5734a6184
Source of Spectrum	B-48-185-0
Wiley ID	1256477