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(R)-2-METHYL-2-(2-THIENYLMETHYL)-PROPANEDIOIC_ACID-METHYLESTER
SpectraBase Compound ID JvXYbOCXieL
InChI InChI=1S/C10H12O4S/c1-10(8(11)12,9(13)14-2)6-7-4-3-5-15-7/h3-5H,6H2,1-2H3,(H,11,12)/t10-/m0/s1
InChIKey RXVLZLOIZXTPOM-JTQLQIEISA-N
Mol Weight 228.26 g/mol
Molecular Formula C10H12O4S
Exact Mass 228.04563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3UQIkBReP3c
Name (R)-2-METHYL-2-(2-THIENYLMETHYL)-PROPANEDIOIC_ACID-METHYLESTER
Compound Number 15B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12O4S
InChI InChI=1S/C10H12O4S/c1-10(8(11)12,9(13)14-2)6-7-4-3-5-15-7/h3-5H,6H2,1-2H3,(H,11,12)/t10-/m0/s1
InChIKey RXVLZLOIZXTPOM-JTQLQIEISA-N
Literature Reference Author CR.NOE,A.WEIGAND,S.PIRKER,P.LIEPERT
Literature Reference Citation MH.CHEM.,128,301(1997)
Literature Reference DOI 10.1007/BF00807896
Molecular Weight 228.263 g/mol
Solvent CDCl3
Source File Reference UWRJ23