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1-Methyl-3-(4-nitrophenyl)-3H-isothiazolo[4,3-b]pyridine 2,2-dioxide
SpectraBase Compound ID 88NwHrUbKqk
InChI InChI=1S/C13H11N3O4S/c1-15-11-3-2-8-14-12(11)13(21(15,19)20)9-4-6-10(7-5-9)16(17)18/h2-8,13H,1H3
InChIKey OBFIIMJVBIPAAU-UHFFFAOYSA-N
Mol Weight 305.31 g/mol
Molecular Formula C13H11N3O4S
Exact Mass 305.047027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhRTFUCCi0K
Name 1-Methyl-3-(4-nitrophenyl)-3H-isothiazolo[4,3-b]pyridine 2,2-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11N3O4S
InChI InChI=1S/C13H11N3O4S/c1-15-11-3-2-8-14-12(11)13(21(15,19)20)9-4-6-10(7-5-9)16(17)18/h2-8,13H,1H3
InChIKey OBFIIMJVBIPAAU-UHFFFAOYSA-N
Molecular Weight 305.308 g/mol
SMILES c12N(S(C(c1nccc2)c1ccc(N(=O)=O)cc1)(=O)=O)C
SPLASH splash10-0006-5982000000-26cd97cdf9ae442b638e
Source of Spectrum SK-27-141-2
Synonyms 1-Methyl-3-(4-nitrophenyl)-3H-[1,2]thiazolo[4,3-b]pyridine 2,2-dioxide
Wiley ID 867634