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Dimethyl (-)-trans-3-Methylcyclohexane-cis,cis-1,2-dicarboxylate
SpectraBase Compound ID DA7TKQBj1jG
InChI InChI=1S/C11H18O4/c1-7-5-4-6-8(10(12)14-2)9(7)11(13)15-3/h7-9H,4-6H2,1-3H3/t7-,8-,9+/m1/s1
InChIKey KCFVOFUNEBMMSS-HLTSFMKQSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EfNTr3BlY0T
Name Dimethyl (-)-trans-3-Methylcyclohexane-cis,cis-1,2-dicarboxylate
Alternate Name(s) (1R,2S,3R)-3-Methyl-cyclohexane-1,2-dicarboxylic acid dimethyl ester Dimethyl (1R,2R,3S)-3-methyl-1,2-cyclohexanedicarboxylate Dimethyl (1R,2S,3R)-3-methylcyclohexane-1,2-dicarboxylate
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Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-7-5-4-6-8(10(12)14-2)9(7)11(13)15-3/h7-9H,4-6H2,1-3H3/t7-,8-,9+/m1/s1
InChIKey KCFVOFUNEBMMSS-HLTSFMKQSA-N
Molecular Weight 214.261 g/mol
SMILES [C@@]1([C@](C(=O)OC)(CCC[C@]1(C)[H])[H])(C(=O)OC)[H]
SPLASH splash10-0006-9200000000-246968a98f2e212e1193
Source of Spectrum J-63-6569-6
Wiley ID 1213425