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(2S,S(S))-2-CYCLOHEXYLSULFINYL-4-(TERT.-BUTYLSULFONYL)-N,N-DIMETHYLPENT-4-ENETHIOAMIDE;MINOR-ISOMER
SpectraBase Compound ID EpGV4wkxWJ
InChI InChI=1S/C17H31NO3S3/c1-13(24(20,21)17(2,3)4)12-15(16(22)18(5)6)23(19)14-10-8-7-9-11-14/h14-15H,1,7-12H2,2-6H3/t15-,23?/m0/s1
InChIKey SPZPDPMDPZBDRO-NGMICRHFSA-N
Mol Weight 393.62 g/mol
Molecular Formula C17H31NO3S3
Exact Mass 393.146607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4pXyO8LZ8xG
Name (2S,S(S))-2-CYCLOHEXYLSULFINYL-4-(TERT.-BUTYLSULFONYL)-N,N-DIMETHYLPENT-4-ENETHIOAMIDE;MINOR-ISOMER
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H31NO3S3
InChI InChI=1S/C17H31NO3S3/c1-13(24(20,21)17(2,3)4)12-15(16(22)18(5)6)23(19)14-10-8-7-9-11-14/h14-15H,1,7-12H2,2-6H3/t15-,23?/m0/s1
InChIKey SPZPDPMDPZBDRO-NGMICRHFSA-N
Literature Reference Author S.NOWACZYK,C.ALAYRAC,P.METZNER,M.T.AVERBUCH-POUCHOT
Literature Reference Citation J.ORG.CHEM.,67,6852(2002)
Literature Reference DOI 10.1021/jo0258610
Molecular Weight 393.618 g/mol
Solvent CDCl3
Source File Reference UWSI22113