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4-(CYCLO-HEX-1-EN-1-YL-1H-1,2,3-TRIAZOL-1-YL)-METHYL-BENZOIC-ACID
SpectraBase Compound ID WYe7RqLdB7
InChI InChI=1S/C16H17N3O2/c20-16(21)14-8-6-12(7-9-14)10-19-11-15(17-18-19)13-4-2-1-3-5-13/h4,6-9,11H,1-3,5,10H2,(H,20,21)
InChIKey LFMXFGVZOBUFGN-UHFFFAOYSA-N
Mol Weight 283.33 g/mol
Molecular Formula C16H17N3O2
Exact Mass 283.132077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1LVBEI0ucWc
Name 4-(CYCLO-HEX-1-EN-1-YL-1H-1,2,3-TRIAZOL-1-YL)-METHYL-BENZOIC-ACID
Compound Number 11D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17N3O2
InChI InChI=1S/C16H17N3O2/c20-16(21)14-8-6-12(7-9-14)10-19-11-15(17-18-19)13-4-2-1-3-5-13/h4,6-9,11H,1-3,5,10H2,(H,20,21)
InChIKey LFMXFGVZOBUFGN-UHFFFAOYSA-N
Literature Reference Author M.WROBEL,J.AUBE,B.KOENIG
Literature Reference Citation BEIL.J.ORG.CHEM.,8,1027(2012)
Literature Reference DOI 10.3762/bjoc.8.115
Molecular Weight 283.330 g/mol
Solvent DMSO-D6
Source File Reference UWIR10763