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[1R,2S(1S,2R,5S),3Z(1S,2R,5S),4S]-5-Methyl-2-(1-methylethyl)cyclohexyl 3-[2-[[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]-2-oxiethylidene]bicyclo[2.2.1]hept-5-ene-2-carboxylate

View entire compound with spectra: 1 MS (GC)

[1R,2S(1S,2R,5S),3Z(1S,2R,5S),4S]-5-Methyl-2-(1-methylethyl)cyclohexyl 3-[2-[[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]-2-oxiethylidene]bicyclo[2.2.1]hept-5-ene-2-carboxylate
SpectraBase Compound ID GEdXglGGQCx
InChI InChI=1S/C30H46O4/c1-17(2)23-11-7-19(5)13-26(23)33-28(31)16-25-21-9-10-22(15-21)29(25)30(32)34-27-14-20(6)8-12-24(27)18(3)4/h9-10,16-24,26-27,29H,7-8,11-15H2,1-6H3/b25-16-/t19?,20?,21-,22+,23?,24?,26?,27?,29-/m0/s1
InChIKey WUAYZQHYDIHQJT-VKMXFALISA-N
Mol Weight 470.7 g/mol
Molecular Formula C30H46O4
Exact Mass 470.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UyYxxtlnCv
Name [1R,2S(1S,2R,5S),3Z(1S,2R,5S),4S]-5-Methyl-2-(1-methylethyl)cyclohexyl 3-[2-[[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]-2-oxiethylidene]bicyclo[2.2.1]hept-5-ene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H46O4
InChI InChI=1S/C30H46O4/c1-17(2)23-11-7-19(5)13-26(23)33-28(31)16-25-21-9-10-22(15-21)29(25)30(32)34-27-14-20(6)8-12-24(27)18(3)4/h9-10,16-24,26-27,29H,7-8,11-15H2,1-6H3/b25-16-/t19?,20?,21-,22+,23?,24?,26?,27?,29-/m0/s1
InChIKey WUAYZQHYDIHQJT-VKMXFALISA-N
Molecular Weight 470.694 g/mol
SMILES [C@]1(\C([C@@]2(C[C@]1(C=C2)[H])[H])=C/C(OC1C(CCC(C1)C)C(C)C)=O)(C(OC1C(CCC(C1)C)C(C)C)=O)[H]
SPLASH splash10-001i-9000200000-4941031bddf349b8186d
Source of Spectrum J-61-2037-4
Synonyms 2-isopropyl-5-methylcyclohexyl (3Z)-3-{2-[(2-isopropyl-5-methylcyclohexyl)oxy]-2-oxoethylidene}bicyclo[2.2.1]hept-5-ene-2-carboxylate
Wiley ID 1392965