John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=CEm2dv08HUF SpectraBase Spectrum ID=2b3EpIprRWr

(accessed ).
4-CARBOXY-1-(2,4-DICHLOROPHENYL)-1H-1,2,3-TRIAZOLE-5-ACETIC ACID, DIMETHYL ESTER
SpectraBase Compound ID CEm2dv08HUF
InChI InChI=1S/C13H11Cl2N3O4/c1-21-11(19)6-10-12(13(20)22-2)16-17-18(10)9-4-3-7(14)5-8(9)15/h3-5H,6H2,1-2H3
InChIKey LKQSVFJGJUGZGU-UHFFFAOYSA-N
Mol Weight 344.15 g/mol
Molecular Formula C13H11Cl2N3O4
Exact Mass 343.012661 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2b3EpIprRWr
Name 4-CARBOXY-1-(2,4-DICHLOROPHENYL)-1H-1,2,3-TRIAZOLE-5-ACETIC ACID, DIMETHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11Cl2N3O4
InChI InChI=1S/C13H11Cl2N3O4/c1-21-11(19)6-10-12(13(20)22-2)16-17-18(10)9-4-3-7(14)5-8(9)15/h3-5H,6H2,1-2H3
InChIKey LKQSVFJGJUGZGU-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 84-86C
Molecular Weight 344.15
Solvent CDCl3; Reference=TMS; Temperature 297K
SpectraBase Batch ID 3B50OUPQbGM