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(1-S,2-E,4-S,7-Z,11-E)-2,7,11-CEMBRATRIEN-4-OL-6-ONE
SpectraBase Compound ID 5nHUoeXnW3a
InChI InChI=1S/C20H32O2/c1-15(2)18-10-9-16(3)7-6-8-17(4)13-19(21)14-20(5,22)12-11-18/h7,11-13,15,18,22H,6,8-10,14H2,1-5H3/b12-11+,16-7+,17-13-/t18-,20-/m1/s1
InChIKey NADZCBHRMMBZFH-REXGYXJXSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Z0SaDMyY3h
Name (1-S,2-E,4-S,7-Z,11-E)-2,7,11-CEMBRATRIEN-4-OL-6-ONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-15(2)18-10-9-16(3)7-6-8-17(4)13-19(21)14-20(5,22)12-11-18/h7,11-13,15,18,22H,6,8-10,14H2,1-5H3/b12-11+,16-7+,17-13-/t18-,20-/m1/s1
InChIKey NADZCBHRMMBZFH-REXGYXJXSA-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 304.473 g/mol
Sample ID 27257
Solvent CDCl3