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N-[[TRANS-(2-PHENYLCYCLOHEXYL)-OXY]-CARBONYL]-CIS-BICYCLO-[3.3.0]-3-OCT-ENDO-2-ENESULFINAMIDE
SpectraBase Compound ID 5ofeqifaCk4
InChI InChI=1S/C21H27NO3S/c23-21(22-26(24)20-14-13-16-9-6-11-18(16)20)25-19-12-5-4-10-17(19)15-7-2-1-3-8-15/h1-3,7-8,13-14,16-20H,4-6,9-12H2,(H,22,23)/t16-,17?,18-,19?,20-,26?/m0/s1
InChIKey JFJYIEIQAXWPJD-RDKQSXBCSA-N
Mol Weight 373.51 g/mol
Molecular Formula C21H27NO3S
Exact Mass 373.171165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HNiw9BobVPV
Name N-[[TRANS-(2-PHENYLCYCLOHEXYL)-OXY]-CARBONYL]-CIS-BICYCLO-[3.3.0]-3-OCT-ENDO-2-ENESULFINAMIDE
Compound Number [( S)-12]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H27NO3S
InChI InChI=1S/C21H27NO3S/c23-21(22-26(24)20-14-13-16-9-6-11-18(16)20)25-19-12-5-4-10-17(19)15-7-2-1-3-8-15/h1-3,7-8,13-14,16-20H,4-6,9-12H2,(H,22,23)/t16-,17?,18-,19?,20-,26?/m0/s1
InChIKey JFJYIEIQAXWPJD-RDKQSXBCSA-N
Literature Reference Author J.K.WHITESELL,J.F.CARPENTER,H.K.YASER,T.MACHAJEWSKI
Literature Reference Citation J.AM.CHEM.SOC.,112,7653(1990)
Literature Reference DOI 10.1021/ja00177a029
Molecular Weight 373.510 g/mol
Solvent CDCl3
Source File Reference UWSI1010