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(1R,2S,5R)-5-Methyl-2-(2'-phenylpropan-2'-yl)cyclohexyl cinnamate
SpectraBase Compound ID BdPd56xCxj1
InChI InChI=1S/C25H30O2/c1-19-14-16-22(25(2,3)21-12-8-5-9-13-21)23(18-19)27-24(26)17-15-20-10-6-4-7-11-20/h4-13,15,17,19,22-23H,14,16,18H2,1-3H3/b17-15+/t19-,22-,23-/m1/s1
InChIKey SHMMAULPKZELJD-DYOFNLSWSA-N
Mol Weight 362.51 g/mol
Molecular Formula C25H30O2
Exact Mass 362.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6K98TXQBeS9
Name (1R,2S,5R)-5-Methyl-2-(2'-phenylpropan-2'-yl)cyclohexyl cinnamate
Alternate Name(s) (1R,2S,5R)-5-methyl-2-(1-methyl-1-phenylethyl)cyclohexyl (2E)-3-phenyl-2-propenoate (E)-3-phenyl-2-propenoic acid[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl]ester (E)-3-phenylacrylic acid[(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl]ester [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl](E)-3-phenylprop-2-enoate [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl](E)-3-phenylprop-2-enoate (E)-3-phenyl-2-propenoic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (E)-3-phenylprop-2-enoate [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (E)-3-phenylprop-2-enoate
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Formula C25H30O2
InChI InChI=1S/C25H30O2/c1-19-14-16-22(25(2,3)21-12-8-5-9-13-21)23(18-19)27-24(26)17-15-20-10-6-4-7-11-20/h4-13,15,17,19,22-23H,14,16,18H2,1-3H3/b17-15+/t19-,22-,23-/m1/s1
InChIKey SHMMAULPKZELJD-DYOFNLSWSA-N
Molecular Weight 362.513 g/mol
SMILES [C@]1([C@](OC(\C=C\c2ccccc2)=O)(C[C@@](CC1)(C)[H])[H])(C(c1ccccc1)(C)C)[H]
SPLASH splash10-014i-0900000000-2ef750a083b1e9977f18
Source of Spectrum KC-0-306-1
Wiley ID 782991