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3-Methyl-5-nitro-2-oxidanidyl-1,2-benzoxazol-2-ium
SpectraBase Compound ID 3Cd7mlaiHrS
InChI InChI=1S/C8H6N2O4/c1-5-7-4-6(9(11)12)2-3-8(7)14-10(5)13/h2-4H,1H3
InChIKey GHSVYNKDLCHTOS-UHFFFAOYSA-N
Mol Weight 194.15 g/mol
Molecular Formula C8H6N2O4
Exact Mass 194.032757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhYGbZ7OvTs
Name 3-Methyl-5-nitro-2-oxidanidyl-1,2-benzoxazol-2-ium
Alternate Name(s) 3-Methyl-5-nitro-2-oxido-1,2-benzoxazol-2-ium 3-Methyl-5-nitro-2-oxido-indoxazen-2-ium
CAS Registry Number 97937-80-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N2O4
InChI InChI=1S/C8H6N2O4/c1-5-7-4-6(9(11)12)2-3-8(7)14-10(5)13/h2-4H,1H3
InChIKey GHSVYNKDLCHTOS-UHFFFAOYSA-N
Molecular Weight 194.146 g/mol
SMILES c1([n+](oc2ccc(cc12)N(=O)=O)[O-])C
SPLASH splash10-03xu-9800000000-c0ae3e47281b54cf40a2
Source of Spectrum Y-22-690-6
Wiley ID 1190122