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6-[(4-Methylphenyl)sulfonyl]-5,6-dihydro-2H-1,6-benzothiazocine 1,1-dioxide
SpectraBase Compound ID AbjnEq6aZ40
InChI InChI=1S/C17H17NO4S2/c1-14-8-10-15(11-9-14)24(21,22)18-12-4-5-13-23(19,20)17-7-3-2-6-16(17)18/h2-11H,12-13H2,1H3/b5-4-
InChIKey BZHDWIHVNNMADJ-PLNGDYQASA-N
Mol Weight 363.45 g/mol
Molecular Formula C17H17NO4S2
Exact Mass 363.0599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6adPEZFzPTy
Name 6-[(4-Methylphenyl)sulfonyl]-5,6-dihydro-2H-1,6-benzothiazocine 1,1-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO4S2
InChI InChI=1S/C17H17NO4S2/c1-14-8-10-15(11-9-14)24(21,22)18-12-4-5-13-23(19,20)17-7-3-2-6-16(17)18/h2-11H,12-13H2,1H3/b5-4-
InChIKey BZHDWIHVNNMADJ-PLNGDYQASA-N
Molecular Weight 363.446 g/mol
SMILES C1S(c2c(N(C\C=C/1)S(=O)(=O)c1ccc(cc1)C)cccc2)(=O)=O
SPLASH splash10-00kf-9120000000-6adc9c5bf8b4cfd58872
Source of Spectrum Y1-45-9175-21
Wiley ID 1622288