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dimethyl (1'R,2'R,5'R)-2-(2'-isopropenyl-5'-methylcyclohex-1'-yl)-propane-1,3-dioate
SpectraBase Compound ID IEP2XMbXeD5
InChI InChI=1S/C15H24O4/c1-9(2)11-7-6-10(3)8-12(11)13(14(16)18-4)15(17)19-5/h10-13H,1,6-8H2,2-5H3/t10-,11+,12-/m1/s1
InChIKey AHQWKJDVRCSTTJ-GRYCIOLGSA-N
Mol Weight 268.35 g/mol
Molecular Formula C15H24O4
Exact Mass 268.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EpzBVixU7rz
Name dimethyl (1'R,2'R,5'R)-2-(2'-isopropenyl-5'-methylcyclohex-1'-yl)-propane-1,3-dioate
Alternate Name(s) dimethyl 2-[(1R,2R,5R)-2-isopropenyl-5-methylcyclohexyl]malonate 2-[(1R,2R,5R)-5-methyl-2-(1-methylethenyl)cyclohexyl]propanedioic acid dimethyl ester dimethyl 2-[(1R,2R,5R)-5-methyl-2-prop-1-en-2-ylcyclohexyl]propanedioate dimethyl 2-[(1R,2R,5R)-2-isopropenyl-5-methyl-cyclohexyl]propanedioate dimethyl 2-[(1R,2R,5R)-5-methyl-2-prop-1-en-2-yl-cyclohexyl]propanedioate
CAS Registry Number 106431-81-6
Comments Less than 3 mono-isotopic peaks
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Formula C15H24O4
InChI InChI=1S/C15H24O4/c1-9(2)11-7-6-10(3)8-12(11)13(14(16)18-4)15(17)19-5/h10-13H,1,6-8H2,2-5H3/t10-,11+,12-/m1/s1
InChIKey AHQWKJDVRCSTTJ-GRYCIOLGSA-N
Molecular Weight 268.353 g/mol
SMILES C([C@]1([C@](C(=C)C)(CC[C@](C1)(C)[H])[H])[H])(C(=O)OC)C(=O)OC
SPLASH splash10-000i-0900000000-6f2da485e4ac3a619732
Source of Spectrum J-54-3127-15
Wiley ID 1272187