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3-Methyl-6-nitro-2-oxidanidyl-1,2-benzoxazol-2-ium

View entire compound with spectra: 1 MS (GC)

3-Methyl-6-nitro-2-oxidanidyl-1,2-benzoxazol-2-ium
SpectraBase Compound ID F9BtAOn3HCj
InChI InChI=1S/C8H6N2O4/c1-5-7-3-2-6(9(11)12)4-8(7)14-10(5)13/h2-4H,1H3
InChIKey PLTAFUWAKJNERG-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 43zFHattTpI
Name 3-Methyl-6-nitro-2-oxidanidyl-1,2-benzoxazol-2-ium
Alternate Name(s) 3-Methyl-6-nitro-2-oxido-1,2-benzoxazol-2-ium 3-Methyl-6-nitro-2-oxido-indoxazen-2-ium
CAS Registry Number 97937-81-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N2O4
InChI InChI=1S/C8H6N2O4/c1-5-7-3-2-6(9(11)12)4-8(7)14-10(5)13/h2-4H,1H3
InChIKey PLTAFUWAKJNERG-UHFFFAOYSA-N
Molecular Weight 194.146 g/mol
SMILES c12o[n+](c(c1ccc(c2)N(=O)=O)C)[O-]
SPLASH splash10-03dl-6900000000-59183f8a76d62b3ccd50
Source of Spectrum Y-22-690-7
Wiley ID 1190123