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6-nitro-2-benzothiazolethiol
SpectraBase Compound ID ElKgGc1L6Xw
InChI InChI=1S/C7H4N2O2S2/c10-9(11)4-1-2-5-6(3-4)13-7(12)8-5/h1-3H,(H,8,12)
InChIKey QPOZGXKWWKLJDK-UHFFFAOYSA-N
Mol Weight 212.24 g/mol
Molecular Formula C7H4N2O2S2
Exact Mass 211.97142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NjRvxklNXd
Name 2(3H)-Benzothiazolethione, 6-nitro-
Alternate Name(s) 6-Nitro-1,3-benzothiazole-2-thiol 2-Benzothiazolethiol, 6-nitro- 2-Benzothiazolinethione, 6-nitro- 2-Mercapto-6-nitrobenzothiazole 6-Nitro-2-mercaptobenzothiazole 6-Nitro-3H-1,3-benzothiazole-2-thione 6-Nitrobenzothiazole-2-thiol Benzothiazole, 2-mercapto-6-nitro- Benzothiazole-2-thiol, 6-nitro- NSC 2630 USAF EK-3991
CAS Registry Number 4845-58-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4N2O2S2
InChI InChI=1S/C7H4N2O2S2/c10-9(11)4-1-2-5-6(3-4)13-7(12)8-5/h1-3H,(H,8,12)
InChIKey QPOZGXKWWKLJDK-UHFFFAOYSA-N
Molecular Weight 212.241 g/mol
SMILES Sc1sc2cc(N(=O)=O)ccc2n1
SPLASH splash10-03di-2980000000-b13214676454535364f5
Source of Spectrum T-68-766-0
Wiley ID 1210767