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Cyclohexanecarboxylic acid, 1,2-bis(acetyloxy)-3-methyl-5-methylene-, methyl ester, (1.alpha.,2.beta.,3.alpha.)-
SpectraBase Compound ID 2ysLixuolzE
InChI InChI=1S/C14H20O6/c1-8-6-9(2)12(19-10(3)15)14(7-8,13(17)18-5)20-11(4)16/h9,12H,1,6-7H2,2-5H3/t9-,12+,14-/m1/s1
InChIKey CNHFMUGZIMANNW-LJWDBELGSA-N
Mol Weight 284.31 g/mol
Molecular Formula C14H20O6
Exact Mass 284.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KnrpieurBuH
Name Cyclohexanecarboxylic acid, 1,2-bis(acetyloxy)-3-methyl-5-methylene-, methyl ester, (1.alpha.,2.beta.,3.alpha.)-
CAS Registry Number 80448-45-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O6
InChI InChI=1S/C14H20O6/c1-8-6-9(2)12(19-10(3)15)14(7-8,13(17)18-5)20-11(4)16/h9,12H,1,6-7H2,2-5H3/t9-,12+,14-/m1/s1
InChIKey CNHFMUGZIMANNW-LJWDBELGSA-N
Molecular Weight 284.308 g/mol
SMILES [C@@]1([C@]([C@](C)(CC(C1)=C)[H])(OC(=O)C)[H])(C(=O)OC)OC(=O)C
SPLASH splash10-0a4j-2900000000-ef40f7cc38b7210efaf3
Source of Spectrum C-104-1012-0
Synonyms Methyl (1R,2S,3R)-1,2-bis(acetyloxy)-3-methyl-5-methylenecyclohexanecarboxylate Methyl 1,trans-2-diacetoxy-trans-3-methyl-5-methylenecyclohexanecarboxylate
Wiley ID 1287641