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Methyl 2-Hydroxy-6-(2-methoxy-2-oxoethyl)-4-(phenylsulfanyl)benzoate
SpectraBase Compound ID 5d8sRDOHbGw
InChI InChI=1S/C17H16O5S/c1-21-15(19)9-11-8-13(23-12-6-4-3-5-7-12)10-14(18)16(11)17(20)22-2/h3-8,10,18H,9H2,1-2H3
InChIKey DNZJNLZQKXUBAW-UHFFFAOYSA-N
Mol Weight 332.37 g/mol
Molecular Formula C17H16O5S
Exact Mass 332.071845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FFXGO9sAGfh
Name Methyl 2-Hydroxy-6-(2-methoxy-2-oxoethyl)-4-(phenylsulfanyl)benzoate
Alternate Name(s) Methyl 2-hydroxy-6-(2-methoxy-2-oxoethyl)-4-(phenylthio)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O5S
InChI InChI=1S/C17H16O5S/c1-21-15(19)9-11-8-13(23-12-6-4-3-5-7-12)10-14(18)16(11)17(20)22-2/h3-8,10,18H,9H2,1-2H3
InChIKey DNZJNLZQKXUBAW-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200900348
Molecular Weight 332.370 g/mol
SMILES Oc1c(C(=O)OC)c(cc(c1)Sc1ccccc1)CC(=O)OC
SPLASH splash10-05ai-0196000000-8f96ea00e01afae80df9
Source of Spectrum H-93-707-3a
Wiley ID 1783958