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BXRIAVFBYZXRCL-MKXNZWAPSA-N
SpectraBase Compound ID 98Cy04hQm3c
InChI InChI=1S/C23H38OS3/c1-19(2)11-7-12-20(3)16(19)8-13-21-14-9-18(21)22(24,15-10-17(20)21)23(25-4,26-5)27-6/h9,14,16-18,24H,7-8,10-13,15H2,1-6H3/t16-,17+,18-,20-,21-,22+/m0/s1
InChIKey BXRIAVFBYZXRCL-MKXNZWAPSA-N
Mol Weight 426.7 g/mol
Molecular Formula C23H38OS3
Exact Mass 426.208479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8cFSZLvt773
Name [3R-(3-BETA,3A-ALPHA,5AS,7A-ALPHA,11A-BETA,11B-ALPHA)]-(+)-1,3,3A,6,7,7A,8,9,10,11,11A,11B-DODECAHYDRO-8,8,11A-TRIMETHYL-3-[TRIS-(METHYLTHIO)-METHYL]-2H-CYCLOB
CAS Registry Number 138750-65-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H38OS3
InChI InChI=1S/C23H38OS3/c1-19(2)11-7-12-20(3)16(19)8-13-21-14-9-18(21)22(24,15-10-17(20)21)23(25-4,26-5)27-6/h9,14,16-18,24H,7-8,10-13,15H2,1-6H3/t16-,17+,18-,20-,21-,22+/m0/s1
InChIKey BXRIAVFBYZXRCL-MKXNZWAPSA-N
Literature Reference Author A.ABAD,M.ARNO,A.C.CUNAT,M.L.MARIN,R.J.ZARAGOZA
Literature Reference Citation J.ORG.CHEM.,57,6861(1992)
Literature Reference DOI 10.1021/jo00051a035
Molecular Weight 426.734 g/mol
Solvent CDCl3
Source File Reference UWCS8279