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2-Methoxy-4-(methylthio)butanoic Acid
SpectraBase Compound ID 4offRttkkmY
InChI InChI=1S/C6H12O3S/c1-9-5(6(7)8)3-4-10-2/h5H,3-4H2,1-2H3,(H,7,8)
InChIKey WICHYTQYSBNZQN-UHFFFAOYSA-N
Mol Weight 164.22 g/mol
Molecular Formula C6H12O3S
Exact Mass 164.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9I9NUIedYCF
Name 2-Methoxy-4-(methylthio)butanoic Acid
Alternate Name(s) 2-Methoxy-4-methylsulfanylbutanoic acid 2-Methoxy-4-methylsulfanyl-butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O3S
InChI InChI=1S/C6H12O3S/c1-9-5(6(7)8)3-4-10-2/h5H,3-4H2,1-2H3,(H,7,8)
InChIKey WICHYTQYSBNZQN-UHFFFAOYSA-N
Molecular Weight 164.219 g/mol
SMILES OC(C(CCSC)OC)=O
SPLASH splash10-03di-9400000000-59f9161153dda55d4436
Source of Spectrum X2-55-56-4
Wiley ID 1604320