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3-(2-Methoxyphenylthio)butanoic acid

View entire compound with spectra: 1 MS (GC)

3-(2-Methoxyphenylthio)butanoic acid
SpectraBase Compound ID 90l4qNse4cY
InChI InChI=1S/C11H14O3S/c1-8(7-11(12)13)15-10-6-4-3-5-9(10)14-2/h3-6,8H,7H2,1-2H3,(H,12,13)
InChIKey LDMQTWOBGOGVQQ-UHFFFAOYSA-N
Mol Weight 226.29 g/mol
Molecular Formula C11H14O3S
Exact Mass 226.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4X1eKH5VY7V
Name 3-(2-Methoxyphenylthio)butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O3S
InChI InChI=1S/C11H14O3S/c1-8(7-11(12)13)15-10-6-4-3-5-9(10)14-2/h3-6,8H,7H2,1-2H3,(H,12,13)
InChIKey LDMQTWOBGOGVQQ-UHFFFAOYSA-N
Molecular Weight 226.290 g/mol
SMILES OC(CC(C)Sc1c(cccc1)OC)=O
SPLASH splash10-004l-0790000000-ac74716d84c960547d81
Source of Spectrum SO-0-84-2
Synonyms 3-[(2-methoxyphenyl)sulfanyl]butanoic acid 3-[(2-methoxyphenyl)thio]butanoic acid 3-(2-Methoxyphenyl)sulfanylbutanoic acid
Wiley ID 1542869