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8-(Methoxycarbonylmethyl)-6-methyl-2-(2-thienyl)-4H-1-benzopyran-4-one
SpectraBase Compound ID 7efp3ZokupD
InChI InChI=1S/C17H14O4S/c1-10-6-11(8-16(19)20-2)17-12(7-10)13(18)9-14(21-17)15-4-3-5-22-15/h3-7,9H,8H2,1-2H3
InChIKey OFGOTRFINGQZTK-UHFFFAOYSA-N
Mol Weight 314.36 g/mol
Molecular Formula C17H14O4S
Exact Mass 314.06128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3mjmhfDqN8
Name 8-(METHOXYCARBONYLMETHYL)-6-METHYL-2-(2-THIENYL)-4H-1-BENZOPYRAN-4-ONE
Compound Number 14E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14O4S
InChI InChI=1S/C17H14O4S/c1-10-6-11(8-16(19)20-2)17-12(7-10)13(18)9-14(21-17)15-4-3-5-22-15/h3-7,9H,8H2,1-2H3
InChIKey OFGOTRFINGQZTK-UHFFFAOYSA-N
Literature Reference Author R.A.AITKEN,M.C.BIBBY,J.A.DOUBLE,R.M.PHILLIPS,S.K.SHARMA
Literature Reference Citation ARCH.PHARM.,329,489(1996)
Literature Reference DOI 10.1002/ardp.19963291104
Molecular Weight 314.356 g/mol
Solvent CDCl3
Source File Reference UWRU10644