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3-Cyclohexene-1-methanol, 2,2,4-trimethyl-, methanesulfonate, (S)-
SpectraBase Compound ID HRae9cvC1i9
InChI InChI=1S/C11H20O3S/c1-9-5-6-10(11(2,3)7-9)8-14-15(4,12)13/h7,10H,5-6,8H2,1-4H3/t10-/m1/s1
InChIKey QKBOTGMYFMTDAT-SNVBAGLBSA-N
Mol Weight 232.34 g/mol
Molecular Formula C11H20O3S
Exact Mass 232.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4c4x9PCbgOe
Name 3-Cyclohexene-1-methanol, 2,2,4-trimethyl-, methanesulfonate, (S)-
CAS Registry Number 127075-64-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O3S
InChI InChI=1S/C11H20O3S/c1-9-5-6-10(11(2,3)7-9)8-14-15(4,12)13/h7,10H,5-6,8H2,1-4H3/t10-/m1/s1
InChIKey QKBOTGMYFMTDAT-SNVBAGLBSA-N
Molecular Weight 232.338 g/mol
SMILES C(OS(=O)(=O)C)[C@@]1(C(C=C(CC1)C)(C)C)[H]
SPLASH splash10-00di-8900000000-d2c4fcb7496e017539d1
Source of Spectrum H-72-1520-0
Synonyms (-)-(S)-2,2,4-Trimethylcyclohex-3-ene-1-methyl methanesulfonate [(1S)-2,2,4-trimethyl-3-cyclohexen-1-yl]methyl methanesulfonate
Wiley ID 1233484