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Methyl 4,5-dimethylcyclooctanecarboxylate
SpectraBase Compound ID 5vUeZJG2etm
InChI InChI=1S/C12H22O2/c1-9-5-4-6-11(12(13)14-3)8-7-10(9)2/h9-11H,4-8H2,1-3H3
InChIKey CDNUCKKSTZFTEG-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 486b8cvFeEi
Name CYCLOOCTANECARBOXYLIC ACID, 4,5-DIMETHYL-, METHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-9-5-4-6-11(12(13)14-3)8-7-10(9)2/h9-11H,4-8H2,1-3H3
InChIKey CDNUCKKSTZFTEG-UHFFFAOYSA-N
Instrument Name CH4
Molecular Weight 198.1614
SMILES C1CC(C(OC)=O)CCC(C)C(C)C1
SPLASH splash10-062l-9200000000-74603962988ae3ff5d96
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany