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Methyl 2-Hydroxy-3,6-dimethyl-5-(phenylsulfonyl)benzoate
SpectraBase Compound ID 7f4J6BqD7zS
InChI InChI=1S/C16H16O5S/c1-10-9-13(11(2)14(15(10)17)16(18)21-3)22(19,20)12-7-5-4-6-8-12/h4-9,17H,1-3H3
InChIKey DHZHAGBZEPRTOC-UHFFFAOYSA-N
Mol Weight 320.36 g/mol
Molecular Formula C16H16O5S
Exact Mass 320.071845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nXNn8JXnL
Name Methyl 2-Hydroxy-3,6-dimethyl-5-(phenylsulfonyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O5S
InChI InChI=1S/C16H16O5S/c1-10-9-13(11(2)14(15(10)17)16(18)21-3)22(19,20)12-7-5-4-6-8-12/h4-9,17H,1-3H3
InChIKey DHZHAGBZEPRTOC-UHFFFAOYSA-N
Molecular Weight 320.359 g/mol
SMILES Oc1c(cc(S(=O)(=O)c2ccccc2)c(c1C(=O)OC)C)C
SPLASH splash10-000i-0091000000-3865832c8508363ffafc
Source of Spectrum F4-41-2228-4b
Wiley ID 1672601