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(3S,4R,RS)-1-[(1S)-ISOBORNEOL-10-SULFINYL]-3-METHOXY-4-(METHOXYCARBONYL)-CYClOHEXENE
SpectraBase Compound ID ADrGzD6Y01T
InChI InChI=1S/C19H30O5S/c1-18(2)12-7-8-19(18,16(20)9-12)11-25(22)13-5-6-14(17(21)24-4)15(10-13)23-3/h10,12,14-16,20H,5-9,11H2,1-4H3/t12-,14-,15-,16+,19-,25?/m0/s1
InChIKey DNGMJEYMGOPWFB-FXXUQYDLSA-N
Mol Weight 370.5 g/mol
Molecular Formula C19H30O5S
Exact Mass 370.181395 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FJ6EWoX3wr8
Name (3S,4R,RS)-1-[(1S)-ISOBORNEOL-10-SULFINYL]-3-METHOXY-4-(METHOXYCARBONYL)-CYClOHEXENE
Compound Number 18AR
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H30O5S
InChI InChI=1S/C19H30O5S/c1-18(2)12-7-8-19(18,16(20)9-12)11-25(22)13-5-6-14(17(21)24-4)15(10-13)23-3/h10,12,14-16,20H,5-9,11H2,1-4H3/t12-,14-,15-,16+,19-,25?/m0/s1
InChIKey DNGMJEYMGOPWFB-FXXUQYDLSA-N
Literature Reference Author M.CAVERSA,A.BARATTUCCI,P.BONACCORSI,P.GIANNETTO,D.N.JONES
Literature Reference Citation J.ORG.CHEM.,62,4376(1997)
Literature Reference DOI 10.1021/jo962286p
Molecular Weight 370.504 g/mol
Solvent CDCl3
Source File Reference UWCP8130