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p-[3-(p-chloro-a-methylbenzyl)-2-thioureido]benzoic acid, ethyl ester
SpectraBase Compound ID LLWHarHCJov
InChI InChI=1S/C18H19ClN2O2S/c1-3-23-17(22)14-6-10-16(11-7-14)21-18(24)20-12(2)13-4-8-15(19)9-5-13/h4-12H,3H2,1-2H3,(H2,20,21,24)
InChIKey NQHMNCJXSKRBOO-UHFFFAOYSA-N
Mol Weight 362.88 g/mol
Molecular Formula C18H19ClN2O2S
Exact Mass 362.085577 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ARNQhPfcnu6
Name p-[3-(p-CHLORO-alpha-METHYLBENZYL)-2-THIOUREIDO]BENZOIC ACID, ETHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19ClN2O2S
InChI InChI=1S/C18H19ClN2O2S/c1-3-23-17(22)14-6-10-16(11-7-14)21-18(24)20-12(2)13-4-8-15(19)9-5-13/h4-12H,3H2,1-2H3,(H2,20,21,24)
InChIKey NQHMNCJXSKRBOO-UHFFFAOYSA-N
Melting Point 137C
Molecular Weight 362.88
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZOIC ACID, P-/3-/P-CHLORO- A-METHYLBENZYL/-2-THIOUREIDO/-, ETHYL ESTER