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2-(BETA,BETA-DICHLOROETHENYL)-5-METHOXYBENZOIC-ACID
SpectraBase Compound ID CsUxrMgaMsh
InChI InChI=1S/C10H8Cl2O3/c1-15-7-3-2-6(4-9(11)12)8(5-7)10(13)14/h2-5H,1H3,(H,13,14)
InChIKey CLZQWMSMRQFYFR-UHFFFAOYSA-N
Mol Weight 247.08 g/mol
Molecular Formula C10H8Cl2O3
Exact Mass 245.98505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJcp2ksDaUU
Name 2-(BETA,BETA-DICHLOROETHENYL)-5-METHOXYBENZOIC-ACID
Compound Number 26A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H8Cl2O3
InChI InChI=1S/C10H8Cl2O3/c1-15-7-3-2-6(4-9(11)12)8(5-7)10(13)14/h2-5H,1H3,(H,13,14)
InChIKey CLZQWMSMRQFYFR-UHFFFAOYSA-N
Literature Reference Author R.A.HILL,S.RUDRA,B.PENG,D.S.ROANE,J.K.BOUNDS,Y.ZHANG,A.ADLOO ,T.LU
Literature Reference Citation BIOORG.MED.CHEM.,11,2099(2003)
Literature Reference DOI 10.1016/S0968-0896(02)00606-5
Molecular Weight 247.078 g/mol
Sample ID 29274
Solvent DMSO-D6