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Pyridine, 2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]-3-nitro-
SpectraBase Compound ID J2uU0YmaZO0
InChI InChI=1S/C8H7N5O2S/c1-12-5-10-11-8(12)16-7-6(13(14)15)3-2-4-9-7/h2-5H,1H3
InChIKey VRUFWNHZEHYWPI-UHFFFAOYSA-N
Mol Weight 237.24 g/mol
Molecular Formula C8H7N5O2S
Exact Mass 237.032046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BCbD8MfUaO
Name Pyridine, 2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]-3-nitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N5O2S
InChI InChI=1S/C8H7N5O2S/c1-12-5-10-11-8(12)16-7-6(13(14)15)3-2-4-9-7/h2-5H,1H3
InChIKey VRUFWNHZEHYWPI-UHFFFAOYSA-N
Molecular Weight 237.237 g/mol
SMILES c1cnc(c(c1)[N+]([O-])=O)Sc1[n](cnn1)C
SPLASH splash10-000l-4900000000-f2679c336a8e1f1aa7a8
Source of Spectrum JX-2015-1-116
Synonyms 2-((4-Methyl-4H-1,2,4-triazol-3-yl)thio)-3-nitropyridine 2-[(4-Methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-nitropyridine 2-[(4-Methyl-1,2,4-triazol-3-yl)thio]-3-nitropyridine 2-[(4-Methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitropyridine 2-[(4-Methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-pyridine
Wiley ID 1720973