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(+)-(3R,4S,R(S))-1-(TERT.-BUTYLSULFINYL)-4-HYDROXY-3-METHYLHEPTAN-2-ONE
SpectraBase Compound ID KxDtPwXi9FZ
InChI InChI=1S/C12H24O3S/c1-6-7-10(13)9(2)11(14)8-16(15)12(3,4)5/h9-10,13H,6-8H2,1-5H3/t9-,10+,16?/m1/s1
InChIKey BWDCVBHEFHLBAB-KXTRXUQASA-N
Mol Weight 248.38 g/mol
Molecular Formula C12H24O3S
Exact Mass 248.144616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AU46i3EQgsI
Name (+)-(3R,4S,R(S))-1-(TERT.-BUTYLSULFINYL)-4-HYDROXY-3-METHYLHEPTAN-2-ONE
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H24O3S
InChI InChI=1S/C12H24O3S/c1-6-7-10(13)9(2)11(14)8-16(15)12(3,4)5/h9-10,13H,6-8H2,1-5H3/t9-,10+,16?/m1/s1
InChIKey BWDCVBHEFHLBAB-KXTRXUQASA-N
Literature Reference Author F.COLOBERT,M.OBRINGER,G.SOLLADIE
Literature Reference Citation EUR.J.ORG.CHEM.,1455(2006)
Molecular Weight 248.381 g/mol
Sample ID 31983
Solvent CDCl3