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Octanoic acid, 2-methylcyclohexyl ester, trans-
SpectraBase Compound ID 4kwjpI2orpg
InChI InChI=1S/C15H28O2/c1-3-4-5-6-7-12-15(16)17-14-11-9-8-10-13(14)2/h13-14H,3-12H2,1-2H3/t13-,14-/m1/s1
InChIKey ZFUKUODGBHPRJR-ZIAGYGMSSA-N
Mol Weight 240.39 g/mol
Molecular Formula C15H28O2
Exact Mass 240.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1w94GPTLvrX
Name Octanoic acid, 2-methylcyclohexyl ester, trans-
Alternate Name(s) (1R,2R)-2-methylcyclohexyl octanoate Octanoic acid [(1R,2R)-2-methylcyclohexyl] ester [(1R,2R)-2-methylcyclohexyl] octanoate
CAS Registry Number 15287-82-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O2
InChI InChI=1S/C15H28O2/c1-3-4-5-6-7-12-15(16)17-14-11-9-8-10-13(14)2/h13-14H,3-12H2,1-2H3/t13-,14-/m1/s1
InChIKey ZFUKUODGBHPRJR-ZIAGYGMSSA-N
Molecular Weight 240.387 g/mol
SMILES C(O[C@]1([C@](C)(CCCC1)[H])[H])(=O)CCCCCCC
SPLASH splash10-052b-9100000000-a680e61dc33034ec0b26
Source of Spectrum SD-1981-0-0
Wiley ID 1243347