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METHYL-5-OXO-5-(2-THIENYL)-PHENYLPENTANOATE

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METHYL-5-OXO-5-(2-THIENYL)-PHENYLPENTANOATE
SpectraBase Compound ID JA3TUrPJASm
InChI InChI=1S/C10H12O3S/c1-13-10(12)6-2-4-8(11)9-5-3-7-14-9/h3,5,7H,2,4,6H2,1H3
InChIKey RVSQTFYOFNOGEQ-UHFFFAOYSA-N
Mol Weight 212.26 g/mol
Molecular Formula C10H12O3S
Exact Mass 212.050715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 53h6GS0L9lh
Name METHYL-5-(2-THIENYL)-5-OXOPENTANOATE
Compound Number 3BA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12O3S
InChI InChI=1S/C10H12O3S/c1-13-10(12)6-2-4-8(11)9-5-3-7-14-9/h3,5,7H,2,4,6H2,1H3
InChIKey RVSQTFYOFNOGEQ-UHFFFAOYSA-N
Literature Reference Author M.YASUDA,K.CHIBA,N.OHIGASHI,Y.KATOH,A.BABA
Literature Reference Citation J.AM.CHEM.SOC.,125,7291(2003)
Literature Reference DOI 10.1021/ja028853+
Molecular Weight 212.263 g/mol
Sample ID 41232
Solvent CDCl3