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1-Benzyl-5-methanesulfonyl-3-nitro-1H-[1,2,4]triazole
SpectraBase Compound ID JFCXqj2Vrba
InChI InChI=1S/C10H10N4O4S/c1-19(17,18)10-11-9(14(15)16)12-13(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
InChIKey GUVWBXIKKNMESX-UHFFFAOYSA-N
Mol Weight 282.27 g/mol
Molecular Formula C10H10N4O4S
Exact Mass 282.042276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2v7W2VM5pI
Name 1-Benzyl-5-methanesulfonyl-3-nitro-1H-[1,2,4]triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10N4O4S
InChI InChI=1S/C10H10N4O4S/c1-19(17,18)10-11-9(14(15)16)12-13(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
InChIKey GUVWBXIKKNMESX-UHFFFAOYSA-N
Molecular Weight 282.274 g/mol
SMILES c1(nc(N(=O)=O)n[n]1Cc1ccccc1)S(=O)(=O)C
SPLASH splash10-0a4l-9800000000-bfd6e96619a4b0a15101
Synonyms 1-Benzyl-5-(methylsulfonyl)-3-nitro-1H-1,2,4-triazole 1-Benzyl-5-mesyl-3-nitro-1,2,4-triazole 1-Benzyl-5-methylsulfonyl-3-nitro-1,2,4-triazole 5-Methylsulfonyl-3-nitro-1-(phenylmethyl)-1,2,4-triazole
Wiley ID 1460960