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(1-R,6-R,7-R,10-S)-DI-1,6-EPI-10-ISOTHIOCYANATO-4-CADINENE
SpectraBase Compound ID EUWa2zV8kdh
InChI InChI=1S/C16H25NS/c1-11(2)13-7-8-16(4,17-10-18)15-6-5-12(3)9-14(13)15/h9,11,13-15H,5-8H2,1-4H3/t13-,14+,15-,16+/m1/s1
InChIKey SRYJMNDTUAKSRD-QXSJWSMHSA-N
Mol Weight 263.44 g/mol
Molecular Formula C16H25NS
Exact Mass 263.170771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Aw0lGC1qRoW
Name (1-R,6-R,7-R,10-S)-DI-1,6-EPI-10-ISOTHIOCYANATO-4-CADINENE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H25NS
InChI InChI=1S/C16H25NS/c1-11(2)13-7-8-16(4,17-10-18)15-6-5-12(3)9-14(13)15/h9,11,13-15H,5-8H2,1-4H3/t13-,14+,15-,16+/m1/s1
InChIKey SRYJMNDTUAKSRD-QXSJWSMHSA-N
Literature Reference Author K.NISHIKAWA,T.UMEZAWA,M.J.GARSON,F.MATSUDA
Literature Reference Citation J.NAT.PROD.,75,2232(2012)
Literature Reference DOI 10.1021/np300439e
Molecular Weight 263.441 g/mol
Sample ID 42116
Solvent CDCl3