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7-NITRO-1H-BENZOTRIAZOLE
SpectraBase Compound ID 9H9gqGRhWT2
InChI InChI=1S/C6H4N4O2/c11-10(12)4-1-2-5-6(3-4)8-9-7-5/h1-3H,(H,7,8,9)
InChIKey AOCDQWRMYHJTMY-UHFFFAOYSA-N
Mol Weight 164.12 g/mol
Molecular Formula C6H4N4O2
Exact Mass 164.033425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CkuMmlQkgzX
Name 1H-Benzotriazole, 5-nitro-
Alternate Name(s) 6-Nitro-1H-benzo[d][1,2,3]triazole 5-Nitro-1H-1,2,3-benzotriazole 1H-Benzotriazole, 6-nitro- 5-Nitro-1H-benzotriazole 5-Nitro-2H-benzotriazole 5-Nitrobenzo-1,2,3-triazole 5-Nitrobenzotriazol 5-Nitrobenzotriazole 6-Nitro-1H-benzotriazole 6-Nitrobenzotriazole NSC 3132 NSC 66476 UN0385
CAS Registry Number 2338-12-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H4N4O2
InChI InChI=1S/C6H4N4O2/c11-10(12)4-1-2-5-6(3-4)8-9-7-5/h1-3H,(H,7,8,9)
InChIKey AOCDQWRMYHJTMY-UHFFFAOYSA-N
Molecular Weight 164.124 g/mol
SMILES [nH]1nnc2c1ccc(c2)N(=O)=O
SPLASH splash10-03di-9200000000-080b097b283e89162b43
Source of Spectrum W5-0-0-0
Wiley ID 1159781