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1,2-Benzisothiazol-3(2H)-one, 4-benzylamino-2-methyl-6-nitro-, 1-oxide
SpectraBase Compound ID H5rhw64pyeq
InChI InChI=1S/C15H13N3O4S/c1-17-15(19)14-12(16-9-10-5-3-2-4-6-10)7-11(18(20)21)8-13(14)23(17)22/h2-8,16H,9H2,1H3
InChIKey NBCXGBPSEUYCMP-UHFFFAOYSA-N
Mol Weight 331.35 g/mol
Molecular Formula C15H13N3O4S
Exact Mass 331.062677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ABuI07RJy6p
Name 1,2-Benzisothiazol-3(2H)-one, 4-benzylamino-2-methyl-6-nitro-, 1-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N3O4S
InChI InChI=1S/C15H13N3O4S/c1-17-15(19)14-12(16-9-10-5-3-2-4-6-10)7-11(18(20)21)8-13(14)23(17)22/h2-8,16H,9H2,1H3
InChIKey NBCXGBPSEUYCMP-UHFFFAOYSA-N
Molecular Weight 331.346 g/mol
SMILES N(c1c2c(S(N(C2=O)C)=O)cc(N(=O)=O)c1)Cc1ccccc1
SPLASH splash10-052f-9435000000-ba45a1247f94a080c3ee
Source of Spectrum H1-68-2494-37
Synonyms 2-Methyl-6-nitro-1-oxidanylidene-4-[(phenylmethyl)amino]-1,2-benzothiazol-3-one 2-Methyl-6-nitro-1-oxo-4-[(phenylmethyl)amino]-1,2-benzothiazol-3-one 4-(benzylamino)-1-keto-2-methyl-6-nitro-1,2-benzothiazol-3-one 4-(benzylamino)-2-methyl-6-nitro-1-oxo-1,2-benzothiazol-3-one
Wiley ID 1593716