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4-[4-(4-METHOXY-2-METHYLPHENYL)-1H-1,2,3-TRIAZOL-1-YL]-BENZOIC-ACID
SpectraBase Compound ID 7XqlYJHBoxe
InChI InChI=1S/C17H15N3O3/c1-11-9-14(23-2)7-8-15(11)16-10-20(19-18-16)13-5-3-12(4-6-13)17(21)22/h3-10H,1-2H3,(H,21,22)
InChIKey ALGSULSZWHGOKX-UHFFFAOYSA-N
Mol Weight 309.33 g/mol
Molecular Formula C17H15N3O3
Exact Mass 309.111341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3AsXP2TGbOP
Name 4-[4-(4-METHOXY-2-METHYLPHENYL)-1H-1,2,3-TRIAZOL-1-YL]-BENZOIC-ACID
Compound Number 12K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15N3O3
InChI InChI=1S/C17H15N3O3/c1-11-9-14(23-2)7-8-15(11)16-10-20(19-18-16)13-5-3-12(4-6-13)17(21)22/h3-10H,1-2H3,(H,21,22)
InChIKey ALGSULSZWHGOKX-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 309.324 g/mol
Solvent DMSO-D6
Source File Reference UWIR10787