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5-[(4-Methylphenyl)sulfonyl]-2,5-dihydro-1,5-benzothiazepine 1,1-dioxide
SpectraBase Compound ID ElAhGdaIwYw
InChI InChI=1S/C16H15NO4S2/c1-13-7-9-14(10-8-13)23(20,21)17-11-4-12-22(18,19)16-6-3-2-5-15(16)17/h2-11H,12H2,1H3
InChIKey FQDQTJLHAATILR-UHFFFAOYSA-N
Mol Weight 349.42 g/mol
Molecular Formula C16H15NO4S2
Exact Mass 349.04425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HNxvfOvZE6d
Name 5-[(4-Methylphenyl)sulfonyl]-2,5-dihydro-1,5-benzothiazepine 1,1-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO4S2
InChI InChI=1S/C16H15NO4S2/c1-13-7-9-14(10-8-13)23(20,21)17-11-4-12-22(18,19)16-6-3-2-5-15(16)17/h2-11H,12H2,1H3
InChIKey FQDQTJLHAATILR-UHFFFAOYSA-N
Molecular Weight 349.419 g/mol
SMILES C1S(c2c(N(C=C1)S(=O)(=O)c1ccc(cc1)C)cccc2)(=O)=O
SPLASH splash10-001i-3940000000-ed0ee87c88ff59c9083e
Source of Spectrum Y1-45-9175-23
Wiley ID 1622287