SpectraBase Spectrum ID |
9go4LASiToK |
Name |
Ethyl 2-[3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazol-5-yl]acetate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
321.132470719 u |
Formula |
C15H19N3O5 |
InChI |
InChI=1S/C15H19N3O5/c1-5-23-13(19)8-12-16-15(18-17-12)9-6-10(20-2)14(22-4)11(7-9)21-3/h6-7H,5,8H2,1-4H3,(H,16,17,18) |
InChIKey |
UGLYVQGPHKLAMV-UHFFFAOYSA-N |
Molecular Weight |
321.333 g/mol |
SMILES |
C=1(C2=CC(OC)=C(C(=C2)OC)OC)N=C(CC(OCC)=O)NN1 |