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p-[3-(o-mercaptophenyl)ureido]benzoic acid, ethyl ester
SpectraBase Compound ID 5soRBG0EPVT
InChI InChI=1S/C16H16N2O3S/c1-2-21-15(19)11-7-9-12(10-8-11)17-16(20)18-13-5-3-4-6-14(13)22/h3-10,22H,2H2,1H3,(H2,17,18,20)
InChIKey CAYURILJDPTOEI-UHFFFAOYSA-N
Mol Weight 316.37 g/mol
Molecular Formula C16H16N2O3S
Exact Mass 316.088164 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CoecLUkxbgG
Name p-[3-(o-MERCAPTOPHENYL)UREIDO]BENZOIC ACID, ETHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N2O3S
InChI InChI=1S/C16H16N2O3S/c1-2-21-15(19)11-7-9-12(10-8-11)17-16(20)18-13-5-3-4-6-14(13)22/h3-10,22H,2H2,1H3,(H2,17,18,20)
InChIKey CAYURILJDPTOEI-UHFFFAOYSA-N
Melting Point 175C
Molecular Weight 316.38
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZOIC ACID, P-/3-/O-MERCAPTOPHENYL/UREIDO/-, ETHYL ESTER