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benzoic acid, 2-[[[1-(2-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]carbonyl]amino]-, ethyl ester

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benzoic acid, 2-[[[1-(2-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]carbonyl]amino]-, ethyl ester
SpectraBase Compound ID DAoD16yt7DU
InChI InChI=1S/C20H20N4O4/c1-4-28-20(26)14-9-5-6-10-15(14)21-19(25)18-13(2)24(23-22-18)16-11-7-8-12-17(16)27-3/h5-12H,4H2,1-3H3,(H,21,25)
InChIKey ONIXHFQPXSBWPX-UHFFFAOYSA-N
Mol Weight 380.4 g/mol
Molecular Formula C20H20N4O4
Exact Mass 380.148455 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6pO4n8H5LLe
Name Benzoic acid, 2-[[[1-(2-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]carbonyl]amino]-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.148455136 u
Formula C20H20N4O4
InChI InChI=1S/C20H20N4O4/c1-4-28-20(26)14-9-5-6-10-15(14)21-19(25)18-13(2)24(23-22-18)16-11-7-8-12-17(16)27-3/h5-12H,4H2,1-3H3,(H,21,25)
InChIKey ONIXHFQPXSBWPX-UHFFFAOYSA-N
Molecular Weight 380.404 g/mol
SMILES N(C(C1=C(N(N=N1)C1=C(OC)C=CC=C1)C)=O)C1=C(C(=O)OCC)C=CC=C1