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Benzenemethanol, 2,6-dimethyl-.alpha.-methylene-, 4-methylbenzenesulfonate
SpectraBase Compound ID 1hViNIO46mA
InChI InChI=1S/C17H18O3S/c1-12-8-10-16(11-9-12)21(18,19)20-15(4)17-13(2)6-5-7-14(17)3/h5-11H,4H2,1-3H3
InChIKey NRSXEZIWUFSODF-UHFFFAOYSA-N
Mol Weight 302.39 g/mol
Molecular Formula C17H18O3S
Exact Mass 302.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxJPSao2brl
Name Benzenemethanol, 2,6-dimethyl-.alpha.-methylene-, 4-methylbenzenesulfonate
Alternate Name(s) 1-(2,6-dimethylphenyl)vinyl 4-methylbenzenesulfonate 1-(2,6-Dimethylphenyl)vinyl tosylate
CAS Registry Number 74331-77-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O3S
InChI InChI=1S/C17H18O3S/c1-12-8-10-16(11-9-12)21(18,19)20-15(4)17-13(2)6-5-7-14(17)3/h5-11H,4H2,1-3H3
InChIKey NRSXEZIWUFSODF-UHFFFAOYSA-N
Molecular Weight 302.388 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)(c1c(cccc1C)C)=C
SPLASH splash10-001i-1900000000-bf2eb8d8a8c22f0576c8
Source of Spectrum J-45-3901-0
Wiley ID 1304619