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3-(2-Methylphenyl)-5,7-dinitro-1,2,3-benzotriazin-4(3H)-one
SpectraBase Compound ID I9u2yQy07Z
InChI InChI=1S/C14H9N5O5/c1-8-4-2-3-5-11(8)17-14(20)13-10(15-16-17)6-9(18(21)22)7-12(13)19(23)24/h2-7H,1H3
InChIKey IMEODLYOJAYHTR-UHFFFAOYSA-N
Mol Weight 327.26 g/mol
Molecular Formula C14H9N5O5
Exact Mass 327.060368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DvwGAgndhmp
Name 3-(2-Methylphenyl)-5,7-dinitro-1,2,3-benzotriazin-4(3H)-one
CAS Registry Number 350793-34-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9N5O5
InChI InChI=1S/C14H9N5O5/c1-8-4-2-3-5-11(8)17-14(20)13-10(15-16-17)6-9(18(21)22)7-12(13)19(23)24/h2-7H,1H3
InChIKey IMEODLYOJAYHTR-UHFFFAOYSA-N
Molecular Weight 327.256 g/mol
SMILES c1ccc(N2C(c3c(N(=O)=O)cc(N(=O)=O)cc3N=N2)=O)c(C)c1
SPLASH splash10-0006-9100000000-66f2b5f66bfc196d767b
Source of Spectrum AD-0-2532-0
Synonyms 1,2,3-Benzotriazin-4(3H)-one, 3-(2-methylphenyl)-5,7-dinitro- 3-(2-Methylphenyl)-5,7-dinitro-1,2,3-benzotriazin-4-one 5,7-Dinitro-3-(o-tolyl)-1,2,3-benzotriazin-4-one
Wiley ID 1435189