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3-(methylthio)propionic acid, methyl ester
SpectraBase Compound ID 7vCj2R8rhmT
InChI InChI=1S/C5H10O2S/c1-7-5(6)3-4-8-2/h3-4H2,1-2H3
InChIKey DMMJVMYCBULSIS-UHFFFAOYSA-N
Mol Weight 134.19 g/mol
Molecular Formula C5H10O2S
Exact Mass 134.040151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5rIj8DEMhi6
Name methyl 3-methylsulfanylpropanoate
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H10O2S
InChI InChI=1S/C5H10O2S/c1-7-5(6)3-4-8-2/h3-4H2,1-2H3
InChIKey DMMJVMYCBULSIS-UHFFFAOYSA-N
Inlet Type Split
Instrument Name Agilent 7890A-5975
Ionization Type EI
Literature Reference DOI 10.1002/anie.202104278
Molecular Weight 134.193 g/mol
Quality 1000
SMILES C(OC)(=O)CCSC
SPLASH splash10-06z9-9300000000-731e3512d52642ad1229
Source of Spectrum ACI-60-SM21-4b (DOI: 10.1002/anie.202104278)
Wiley ID 1891298