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2,5-DICHLOROPHENYLTHIOGLYCOLIC ACID(6274-27-7) IR1
Product Name2,5-DICHLOROPHENYLTHIOGLYCOLIC ACID
CAS6274-27-7
Molecular FormulaC8H6Cl2O2S
Molecular Weight237.1
InChIInChI=1S/C8H6Cl2O2S/c9-5-1-2-6(10)7(3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
InChIKey DCXXCTCEJFBLPD-UHFFFAOYSA-N
SmilesC(O)(=O)CSC1=CC(Cl)=CC=C1Cl
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Assign. Shift(ppm)
A 13. B 7.482 C 7.373 D 7.256 E 4.025Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
169.65 652 1 137.56 461 2 132.21 615 3 * 130.48 596 4 # 128.84 454 5 * 125.98 1000 6 # 7 33.48 311 8Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : nujol mull
