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(1-S,2-E,4-S,6-R,7-E,11-S)-2,7,12-(20)-CEMBRATRIENE-11-CHLORO-4,6-DIOL
SpectraBase Compound ID UyStihZ0WC
InChI InChI=1S/C20H33ClO2/c1-14(2)17-8-7-16(4)19(21)9-6-15(3)12-18(22)13-20(5,23)11-10-17/h10-12,14,17-19,22-23H,4,6-9,13H2,1-3,5H3/b11-10+,15-12+/t17-,18+,19+,20-/m1/s1
InChIKey WNXMFFHRLCVFLB-KPMUHUKBSA-N
Mol Weight 340.9 g/mol
Molecular Formula C20H33ClO2
Exact Mass 340.216908 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FdjE1vAU2Sq
Name (1-S,2-E,4-S,6-R,7-E,11-S)-2,7,12-(20)-CEMBRATRIENE-11-CHLORO-4,6-DIOL
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H33ClO2
InChI InChI=1S/C20H33ClO2/c1-14(2)17-8-7-16(4)19(21)9-6-15(3)12-18(22)13-20(5,23)11-10-17/h10-12,14,17-19,22-23H,4,6-9,13H2,1-3,5H3/b11-10+,15-12+/t17-,18+,19+,20-/m1/s1
InChIKey WNXMFFHRLCVFLB-KPMUHUKBSA-N
Literature Reference Author K.A.ELSAYED,S.LAPHOOKHIEO,M.YOUSAF,J.A.PRESTRIDGE,A.B.SHIROD E,V.B.WALI,P.W.SYLVE
Literature Reference Citation J.NAT.PROD.,71,117(2008)
Literature Reference DOI 10.1021/np0704351
Molecular Weight 340.934 g/mol
Sample ID 27259
Solvent CDCl3