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TRANS,CIS-3,5-DIMETHYL-1-(PHENYLTHIO)-TRANS,CIS,CIS-2,3,4-TRIHYDROXYCYCLOHEXANE-3,4-ACETONIDE
SpectraBase Compound ID A4jphYLCpOd
InChI InChI=1S/C17H24O3S/c1-11-10-13(21-12-8-6-5-7-9-12)14(18)17(4)15(11)19-16(2,3)20-17/h5-9,11,13-15,18H,10H2,1-4H3/t11-,13+,14-,15-,17+/m0/s1
InChIKey GEJMFOHEJDAIJA-GKUYLULISA-N
Mol Weight 308.44 g/mol
Molecular Formula C17H24O3S
Exact Mass 308.144616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DywNMRHaXir
Name TRANS,CIS-3,5-DIMETHYL-1-(PHENYLTHIO)-TRANS,CIS,CIS-2,3,4-TRIHYDROXYCYCLOHEXANE-3,4-ACETONIDE
CAS Registry Number 81939-86-8
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H24O3S
InChI InChI=1S/C17H24O3S/c1-11-10-13(21-12-8-6-5-7-9-12)14(18)17(4)15(11)19-16(2,3)20-17/h5-9,11,13-15,18H,10H2,1-4H3/t11-,13+,14-,15-,17+/m0/s1
InChIKey GEJMFOHEJDAIJA-GKUYLULISA-N
Literature Reference Author A.K.MUSSER,P.L.FUCHS
Literature Reference Citation J.ORG.CHEM.,47,3121(1982)
Literature Reference DOI 10.1021/jo00137a018
Molecular Weight 308.436 g/mol
Solvent CDCl3
Source File Reference UWCS11339