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cis-2-[(3-chloro-o-tolyl)carbamoyl]cyclohexanecarboxylic acid

View entire compound with spectra: 2 NMR, and 1 FTIR

cis-2-[(3-chloro-o-tolyl)carbamoyl]cyclohexanecarboxylic acid
SpectraBase Compound ID 3FA7X48r2N0
InChI InChI=1S/C15H18ClNO3/c1-9-12(16)7-4-8-13(9)17-14(18)10-5-2-3-6-11(10)15(19)20/h4,7-8,10-11H,2-3,5-6H2,1H3,(H,17,18)(H,19,20)/t10-,11+/s2
InChIKey RTWTUKRXFFPXMB-WIBLRKLZSA-N
Mol Weight 295.77 g/mol
Molecular Formula C15H18ClNO3
Exact Mass 295.097521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4tA9i6TZLlA
Name cis-2-[(3-CHLORO-o-TOLYL)CARBAMOYL]CYCLOHEXANECARBOXYLIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18ClNO3
InChI InChI=1S/C15H18ClNO3/c1-9-12(16)7-4-8-13(9)17-14(18)10-5-2-3-6-11(10)15(19)20/h4,7-8,10-11H,2-3,5-6H2,1H3,(H,17,18)(H,19,20)/t10-,11+/s2
InChIKey RTWTUKRXFFPXMB-WIBLRKLZSA-N
Molecular Weight 295.77
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms CYCLOHEXANECARBOXYLIC ACID, 2-//3-CHLORO-O-TOLYL/CARBAMOYL/-, cis-,