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Methyl R-(+)-2-Formyl-2-(phenylthio) butanoate
SpectraBase Compound ID 5Bh7YZuECtj
InChI InChI=1S/C12H14O3S/c1-3-12(9-13,11(14)15-2)16-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3/t12-/m1/s1
InChIKey KEXRJXJINLBKPN-GFCCVEGCSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uONZcd3RF0
Name Methyl R-(+)-2-Formyl-2-(phenylthio) butanoate
Alternate Name(s) Methyl (2R)-2-formyl-2-(phenylsulfanyl)butanoate
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Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-3-12(9-13,11(14)15-2)16-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3/t12-/m1/s1
InChIKey KEXRJXJINLBKPN-GFCCVEGCSA-N
Molecular Weight 238.301 g/mol
SMILES [C@](C(=O)OC)(Sc1ccccc1)(C=O)CC
SPLASH splash10-0a4i-4920000000-76fc84ba0cad7868cb3c
Source of Spectrum K-127-1716-12
Wiley ID 1240248