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Cyclohexanecarboxylic acid, 2-hydroxy-6-methyl-1-(2-propenyl)-, methyl ester, [1S-(1.alpha.,2.beta.,6.alpha.)]-
SpectraBase Compound ID HwBetyEe3gh
InChI InChI=1S/C12H20O3/c1-4-8-12(11(14)15-3)9(2)6-5-7-10(12)13/h4,9-10,13H,1,5-8H2,2-3H3
InChIKey BGGACKMXJDWNED-UHFFFAOYSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KUDoQFuVBxp
Name Cyclohexanecarboxylic acid, 2-hydroxy-6-methyl-1-(2-propenyl)-, methyl ester, [1S-(1.alpha.,2.beta.,6.alpha.)]-
Alternate Name(s) Methyl 1-allyl-2-hydroxy-6-methylcyclohexanecarboxylate Cyclohexan-1-ol-2-carboxylic acid, 2-allyl-3-methyl-, methyl ester (1R,2S)- Methyl (1S,2S,6S)-1-allyl-2-hydroxy-6-methylcyclohexanecarboxylate Methyl 2-hydroxy-6-methyl-1-propylcyclohexanecarboxylate
CAS Registry Number 124899-20-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-4-8-12(11(14)15-3)9(2)6-5-7-10(12)13/h4,9-10,13H,1,5-8H2,2-3H3
InChIKey BGGACKMXJDWNED-UHFFFAOYSA-N
Molecular Weight 212.289 g/mol
SMILES OC1C(C(=O)OC)(C(CCC1)C)CC=C
SPLASH splash10-052f-9800000000-e21d4917bc7a03e670d0
Wiley ID 1479676