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KHZHSUQOQDYQTH-UHFFFAOYSA-N
SpectraBase Compound ID HMjdj7fyQrt
InChI InChI=1S/C14H12O4S/c1-17-13(15)10-6-9(12-4-3-5-19-12)7-11(8-10)14(16)18-2/h3-8H,1-2H3
InChIKey KHZHSUQOQDYQTH-UHFFFAOYSA-N
Mol Weight 276.31 g/mol
Molecular Formula C14H12O4S
Exact Mass 276.04563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BKQH1CjbrBX
Name DIMETHYL-5-(2-THIENYL)-ISOPHTHALATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12O4S
InChI InChI=1S/C14H12O4S/c1-17-13(15)10-6-9(12-4-3-5-19-12)7-11(8-10)14(16)18-2/h3-8H,1-2H3
InChIKey KHZHSUQOQDYQTH-UHFFFAOYSA-N
Literature Reference Author E.CIELEN,A.TAHRI,K.VERHEYEN,G.J.HOORNAERT,F.C.DESCHRYVER,N.B OENS
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1573(1998)
Literature Reference DOI 10.1039/a802183j
Molecular Weight 276.307 g/mol
Solvent CDCl3
Source File Reference UWRU12276