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S-cyclopentyl 4-(acetylamino)benzenesulfonothioate
SpectraBase Compound ID Bi8u7F8bUis
InChI InChI=1S/C13H17NO3S2/c1-10(15)14-11-6-8-13(9-7-11)19(16,17)18-12-4-2-3-5-12/h6-9,12H,2-5H2,1H3,(H,14,15)
InChIKey TXWWQZQXGOHHCE-UHFFFAOYSA-N
Mol Weight 299.4 g/mol
Molecular Formula C13H17NO3S2
Exact Mass 299.064986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYsfDrqVc6d
Name S-cyclopentyl 4-(acetylamino)benzenesulfonothioate
Alternate Name(s) N-(4-cyclopentylsulfanylsulfonylphenyl)acetamide N-(4-cyclopentylsulfanylsulfonylphenyl)ethanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3S2
InChI InChI=1S/C13H17NO3S2/c1-10(15)14-11-6-8-13(9-7-11)19(16,17)18-12-4-2-3-5-12/h6-9,12H,2-5H2,1H3,(H,14,15)
InChIKey TXWWQZQXGOHHCE-UHFFFAOYSA-N
Molecular Weight 299.403 g/mol
SMILES N(c1ccc(S(SC2CCCC2)(=O)=O)cc1)C(C)=O
SPLASH splash10-0005-6910000000-5bd67e94021557631e92
Source of Spectrum IY-1-4267-7
Wiley ID 1650672