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Benzene, 2-azido-1-methyl-3-nitro-
SpectraBase Compound ID 1wX9h6wbUJ6
InChI InChI=1S/C7H6N4O2/c1-5-3-2-4-6(11(12)13)7(5)9-10-8/h2-4H,1H3/b9-7+
InChIKey OTQNEHBYBTZSIK-VQHVLOKHSA-N
Mol Weight 178.15 g/mol
Molecular Formula C7H6N4O2
Exact Mass 178.049075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0giVzcYqW0
Name Benzene, 2-azido-1-methyl-3-nitro-
CAS Registry Number 16714-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6N4O2
InChI InChI=1S/C7H6N4O2/c1-5-3-2-4-6(11(12)13)7(5)9-10-8/h2-4H,1H3/b9-7+
InChIKey OTQNEHBYBTZSIK-VQHVLOKHSA-N
Molecular Weight 178.151 g/mol
SMILES C1(\C(=N\[N+]#N)C(=CC=C1)C)=[N+]([O-])[O-]
SPLASH splash10-0gbi-9100000000-16edee434d20c88599c2
Source of Spectrum J-6-3802-71
Synonyms Toluene, 2-azido-3-nitro- 2-Methyl-6-nitroazidobenzene 2-Methyl-6-nitrophenyl azide
Wiley ID 1173588