| SpectraBase Spectrum ID |
6dfyZ6tB97H |
| Name |
5-(4-Acetamido-2,3-dimethoxyphenyl)-4-isopropenyltropolone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.141972775 u |
| Formula |
C20H21NO5 |
| InChI |
InChI=1S/C20H21NO5/c1-11(2)15-10-18(24)17(23)9-7-13(15)14-6-8-16(21-12(3)22)20(26-5)19(14)25-4/h6-10H,1H2,2-5H3,(H,21,22)(H,23,24) |
| InChIKey |
ZQTMNWYGIZLMBP-UHFFFAOYSA-N |
| Molecular Weight |
355.390 g/mol |
| SMILES |
C1(=C(C=C(O)C(C=C1)=O)C(=C)C)C=1C(=C(OC)C(=CC1)NC(=O)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912141 |
