1,6-Dinitrobenzo[a]pyrene

SpectraBase Compound ID	3XeuHXPRmHG
InChI	InChI=1S/C20H10N2O4/c23-21(24)17-10-6-11-5-7-16-19-13(8-9-15(17)18(11)19)12-3-1-2-4-14(12)20(16)22(25)26/h1-10H
InChIKey	ZBUIFCQCAOFRJN-UHFFFAOYSA-N Google Search
Mol Weight	342.31 g/mol
Molecular Formula	C20H10N2O4
Exact Mass	342.064057 g/mol

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SpectraBase Spectrum ID	87gv33w5kvV
Name	1,6-Dinitrobenzo[a]pyrene
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H10N2O4
InChI	InChI=1S/C20H10N2O4/c23-21(24)17-10-6-11-5-7-16-19-13(8-9-15(17)18(11)19)12-3-1-2-4-14(12)20(16)22(25)26/h1-10H
InChIKey	ZBUIFCQCAOFRJN-UHFFFAOYSA-N
Molecular Weight	342.310 g/mol
SMILES	c12c(c(c3ccc4ccc(c5ccc2c3c45)N(=O)=O)N(=O)=O)cccc1
SPLASH	splash10-0f6x-0096000000-cff9d69be59a4a0c904d
Source of Spectrum	E1-38-3160-5
Wiley ID	1518513