| SpectraBase Spectrum ID |
KQxuXq2hMvY |
| Name |
[1,2,4]Triazino[2,3-A][1,3]benzimidazol-3(5H)-one, 5-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.132805072 u |
| Formula |
C20H18N4O4 |
| InChI |
InChI=1S/C20H18N4O4/c1-12-19(26)21-20-23(14-6-4-5-7-15(14)24(20)22-12)11-16(25)13-8-9-17(27-2)18(10-13)28-3/h4-10H,11H2,1-3H3 |
| InChIKey |
RFJOIQGJLMNJIB-UHFFFAOYSA-N |
| Molecular Weight |
378.388 g/mol |
| SMILES |
C12=CC=CC=C2N(CC(=O)C2=CC(=C(C=C2)OC)OC)C=2N1N=C(C(N2)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891973 |
![[1,2,4]Triazino[2,3-a][1,3]benzimidazol-3(5H)-one, 5-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-methyl-](/api/spectrum/KQxuXq2hMvY/structure.png?h=300&w=458 "[1,2,4]Triazino[2,3-a][1,3]benzimidazol-3(5H)-one, 5-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-methyl-")
