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Benzenemethanol, 4-methoxy-5-methyl-2-[1-methyl-3-(phenylsulfonyl)-1-propenyl]-, acetate, (E)-
SpectraBase Compound ID D4BFwIQOnrs
InChI InChI=1S/C21H24O5S/c1-15(10-11-27(23,24)19-8-6-5-7-9-19)20-13-21(25-4)16(2)12-18(20)14-26-17(3)22/h5-10,12-13H,11,14H2,1-4H3/b15-10+
InChIKey PCWPYPOTMSRTBJ-XNTDXEJSSA-N
Mol Weight 388.48 g/mol
Molecular Formula C21H24O5S
Exact Mass 388.134445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CteozpX3VZm
Name Benzenemethanol, 4-methoxy-5-methyl-2-[1-methyl-3-(phenylsulfonyl)-1-propenyl]-, acetate, (E)-
CAS Registry Number 114092-46-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O5S
InChI InChI=1S/C21H24O5S/c1-15(10-11-27(23,24)19-8-6-5-7-9-19)20-13-21(25-4)16(2)12-18(20)14-26-17(3)22/h5-10,12-13H,11,14H2,1-4H3/b15-10+
InChIKey PCWPYPOTMSRTBJ-XNTDXEJSSA-N
Molecular Weight 388.478 g/mol
SMILES C(S(=O)(=O)c1ccccc1)\C=C\(c1c(cc(c(c1)OC)C)COC(=O)C)C
SPLASH splash10-000i-1900000000-44f82cf85e40c6214abd
Source of Spectrum KC-1987-2180-52
Synonyms 4-Acetomethyl-1-methoxy-2-methyl-5-(4-phenylsulphonylbut-2-en-2-yl)benzene 4-Methoxy-5-methyl-2-[(1E)-1-methyl-3-(phenylsulfonyl)-1-propenyl]benzyl acetate
Wiley ID 1363769