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4-Methyl-6-nitro-2,1,3-benzoxadiazole 1-oxide
SpectraBase Compound ID KiEWIqlKoC1
InChI InChI=1S/C7H5N3O4/c1-4-2-5(9(11)12)3-6-7(4)8-14-10(6)13/h2-3H,1H3
InChIKey DEXNRKXLGKAEOP-UHFFFAOYSA-N
Mol Weight 195.13 g/mol
Molecular Formula C7H5N3O4
Exact Mass 195.028006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hGXBNHYvmg
Name 4-Methyl-6-nitro-2,1,3-benzoxadiazole 1-oxide
Alternate Name(s) 4-Methyl-6-nitrobenzofurazan oxide 4-Methyl-6-nitro-1-oxido-2,1,3-benzoxadiazol-1-ium 4-Methyl-6-nitro-1-oxidanidyl-2,1,3-benzoxadiazol-1-ium
CAS Registry Number 140647-89-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5N3O4
InChI InChI=1S/C7H5N3O4/c1-4-2-5(9(11)12)3-6-7(4)8-14-10(6)13/h2-3H,1H3
InChIKey DEXNRKXLGKAEOP-UHFFFAOYSA-N
Molecular Weight 195.134 g/mol
SMILES C1=C(C=C(C=2C1=N(=O)ON2)C)N(=O)=O
SPLASH splash10-03di-9200000000-338f819564b36f870423
Source of Spectrum B-39-100-0
Wiley ID 1191747