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3-Ethyl-1-methyl 1-methylcyclohexane-trans-1,3-dicarboxylate
SpectraBase Compound ID 1911VETRJYu
InChI InChI=1S/C12H20O4/c1-4-16-10(13)9-6-5-7-12(2,8-9)11(14)15-3/h9H,4-8H2,1-3H3/t9-,12-/m0/s1
InChIKey PSIUIQAFUNESDE-CABZTGNLSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kn8Kgay6HX0
Name 3-Ethyl-1-methyl 1-methylcyclohexane-trans-1,3-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-4-16-10(13)9-6-5-7-12(2,8-9)11(14)15-3/h9H,4-8H2,1-3H3/t9-,12-/m0/s1
InChIKey PSIUIQAFUNESDE-CABZTGNLSA-N
Molecular Weight 228.288 g/mol
SMILES [C@]1(C(=O)OC)(C[C@@](C(=O)OCC)(CCC1)[H])C
SPLASH splash10-000t-8900000000-988a0993c0a057e95fad
Source of Spectrum O-29-342-3t
Synonyms (1S,3S)-1-Methyl-cyclohexane-1,3-dicarboxylic acid 3-ethyl ester 1-methyl ester
Wiley ID 1227378