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2-Hexenoic acid, 3-methyl-6-(octahydro-1a-methyl-5H-indeno[4,5-b]oxiren-5-ylidene)-, methyl ester, [1a,3a.beta.,5(E),6a.beta.,6b.alpha.]-
SpectraBase Compound ID pntr3wittN
InChI InChI=1S/C18H26O3/c1-12(9-16(19)20-3)5-4-6-13-10-14-7-8-18(2)17(21-18)15(14)11-13/h6,9,14-15,17H,4-5,7-8,10-11H2,1-3H3/b12-9+,13-6+/t14-,15+,17-,18?/m1/s1
InChIKey CCLWIQDRKJOPTO-JIXPOSPQSA-N
Mol Weight 290.4 g/mol
Molecular Formula C18H26O3
Exact Mass 290.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1orY2dupRYR
Name 2-Hexenoic acid, 3-methyl-6-(octahydro-1a-methyl-5H-indeno[4,5-b]oxiren-5-ylidene)-, methyl ester, [1a,3a.beta.,5(E),6a.beta.,6b.alpha.]-
Alternate Name(s) 5H-indeno[4,5-b]oxirene, 2-hexenoic acid deriv. Methyl (2E,6E)-6-[(3aR,6aS,6bR)-1a-methyloctahydro-5H-indeno[4,5-b]oxiren-5-ylidene]-3-methyl-2-hexenoate Methyl cis-10,11-epoxy-7'',9:7'',13-cis-cyclo-7-ethyl-3,11-dimethyltrideca-22e,6.XI.-dienoate Methyl cis-10,11-epoxy-7'',9:7'',13-cis-cyclo-7-ethyl-3,11-dimethyltrideca-22E,6.xi.-dienoate
CAS Registry Number 92464-18-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O3
InChI InChI=1S/C18H26O3/c1-12(9-16(19)20-3)5-4-6-13-10-14-7-8-18(2)17(21-18)15(14)11-13/h6,9,14-15,17H,4-5,7-8,10-11H2,1-3H3/b12-9+,13-6+/t14-,15+,17-,18?/m1/s1
InChIKey CCLWIQDRKJOPTO-JIXPOSPQSA-N
Molecular Weight 290.403 g/mol
SMILES C12(O[C@@]1([C@@]1([C@](CC2)(C\C(C1)=C\CC\C(=C\C(=O)OC)C)[H])[H])[H])C
SPLASH splash10-0a5c-9500000000-8ba1eeaa1a56c8dabd12
Source of Spectrum F-40-1877-0
Wiley ID 1293882