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4-[4-(3-CHLOROPHENYL)-1H-1,2,3-TRIAZOL-1-YL]-BENZOIC-ACID
SpectraBase Compound ID 2byHyD7MyYA
InChI InChI=1S/C15H10ClN3O2/c16-12-3-1-2-11(8-12)14-9-19(18-17-14)13-6-4-10(5-7-13)15(20)21/h1-9H,(H,20,21)
InChIKey NRRZMEXEFOTTJQ-UHFFFAOYSA-N
Mol Weight 299.72 g/mol
Molecular Formula C15H10ClN3O2
Exact Mass 299.046154 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9r0J4NXIABc
Name 4-[4-(3-CHLOROPHENYL)-1H-1,2,3-TRIAZOL-1-YL]-BENZOIC-ACID
Compound Number 12D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H10ClN3O2
InChI InChI=1S/C15H10ClN3O2/c16-12-3-1-2-11(8-12)14-9-19(18-17-14)13-6-4-10(5-7-13)15(20)21/h1-9H,(H,20,21)
InChIKey NRRZMEXEFOTTJQ-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 299.716 g/mol
Solvent DMSO-D6
Source File Reference UWIR10784