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methyl (1S,2S,4S)-2-hydroxy-4-isopropyl-cyclohexanecarboxylate
SpectraBase Compound ID InvJvEQlKxv
InChI InChI=1S/C11H20O3/c1-7(2)8-4-5-9(10(12)6-8)11(13)14-3/h7-10,12H,4-6H2,1-3H3/t8-,9-,10-/m0/s1
InChIKey OCICXWOQAORYEK-GUBZILKMSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GfKmObcNXEk
Name methyl (1S,2S,4S)-2-hydroxy-4-isopropyl-cyclohexanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-7(2)8-4-5-9(10(12)6-8)11(13)14-3/h7-10,12H,4-6H2,1-3H3/t8-,9-,10-/m0/s1
InChIKey OCICXWOQAORYEK-GUBZILKMSA-N
Instrument Name Agilent 6890
Ionization Type EI
Literature Reference DOI 10.1002/chem.201805837
Molecular Weight 200.278 g/mol
SMILES O[C@@]1([C@](CC[C@@](C1)(C(C)C)[H])(C(OC)=O)[H])[H]
SPLASH splash10-0a6r-9700000000-274294e5cfab9904833a
Source of Spectrum QE-25-4726-17c
Wiley ID 1851833