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3-[(carboxymethyl)thio]-4-hydroxyvaleric acid, gamma-lactone
SpectraBase Compound ID BqoKyhaWLx6
InChI InChI=1S/C7H10O4S/c1-4-5(2-7(10)11-4)12-3-6(8)9/h4-5H,2-3H2,1H3,(H,8,9)
InChIKey UJXLNADQHMYDRM-UHFFFAOYSA-N
Mol Weight 190.21 g/mol
Molecular Formula C7H10O4S
Exact Mass 190.02998 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID TAJMnERtx7
Name 3-[(carboxymethyl)thio]-4-hydroxyvaleric acid, gamma-lactone
Source of Sample G. Fuchs, Agricultural College of Sweden, Uppsala, Sweden
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Formula C7H10O4S
InChI InChI=1S/C7H10O4S/c1-4-5(2-7(10)11-4)12-3-6(8)9/h4-5H,2-3H2,1H3,(H,8,9)
InChIKey UJXLNADQHMYDRM-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 5182M
Solvent TFA
Synonyms VALERIC ACID, 3-//CARBOXYMETHYL/- THIO/-4-HYDROXY-, G-LACTONE