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4-Nitro-2,1,3-benzothiadiazole
SpectraBase Compound ID 1OWW65YdkmJ
InChI InChI=1S/C6H3N3O2S/c10-9(11)5-3-1-2-4-6(5)8-12-7-4/h1-3H
InChIKey IWQKAMJGVIHECB-UHFFFAOYSA-N
Mol Weight 181.17 g/mol
Molecular Formula C6H3N3O2S
Exact Mass 180.994598 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 47pRr9tYgTa
Name 2,1,3-Benzothiadiazole, 4-nitro-
Alternate Name(s) 4-(hydroxy(oxido)amino)-2,1,3-benzothiadiazole 4-Nitro-1,2,3-benzothiadiazole 4-Nitro-2,1,3-benzothiadiazole 4-Nitropiazthiole EINECS 229-514-5 NSC 404747
CAS Registry Number 6583-06-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H3N3O2S
InChI InChI=1S/C6H3N3O2S/c10-9(11)5-3-1-2-4-6(5)8-12-7-4/h1-3H
InChIKey IWQKAMJGVIHECB-UHFFFAOYSA-N
Molecular Weight 181.169 g/mol
SMILES c1(N(=O)=O)c2c(nsn2)ccc1
SPLASH splash10-001r-3900000000-bc1146f3820e9057000c
Source of Spectrum SB-29-623-0
Wiley ID 1177185