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Methyl 3-Butyl-2-hydroxy-6-methyl-5-(phenylsulfonyl)benzoate
SpectraBase Compound ID 87PaGGbca4g
InChI InChI=1S/C19H22O5S/c1-4-5-9-14-12-16(13(2)17(18(14)20)19(21)24-3)25(22,23)15-10-7-6-8-11-15/h6-8,10-12,20H,4-5,9H2,1-3H3
InChIKey CMEMIIKZMUTIPG-UHFFFAOYSA-N
Mol Weight 362.44 g/mol
Molecular Formula C19H22O5S
Exact Mass 362.118795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID g6Qjn7FWuE
Name Methyl 3-Butyl-2-hydroxy-6-methyl-5-(phenylsulfonyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O5S
InChI InChI=1S/C19H22O5S/c1-4-5-9-14-12-16(13(2)17(18(14)20)19(21)24-3)25(22,23)15-10-7-6-8-11-15/h6-8,10-12,20H,4-5,9H2,1-3H3
InChIKey CMEMIIKZMUTIPG-UHFFFAOYSA-N
Molecular Weight 362.440 g/mol
SMILES Oc1c(cc(S(=O)(=O)c2ccccc2)c(c1C(=O)OC)C)CCCC
SPLASH splash10-0gw0-0079000000-1ebd1dab2e675ef47409
Source of Spectrum F4-41-2228-4d
Wiley ID 1672599