| SpectraBase Spectrum ID |
GKO3abZTU2K |
| Name |
2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid (3-acetyl-phenyl)-amide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
297.100107963 u |
| Formula |
C17H15NO4 |
| InChI |
InChI=1S/C17H15NO4/c1-11(19)12-5-4-6-13(9-12)18-17(20)16-10-21-14-7-2-3-8-15(14)22-16/h2-9,16H,10H2,1H3,(H,18,20) |
| InChIKey |
FQPAQXUCQSQPHL-UHFFFAOYSA-N |
| SMILES |
C=12C(OCC(O2)C(NC=2C=C(C=CC2)C(C)=O)=O)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959475 |
![2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid (3-acetyl-phenyl)-amide](/api/spectrum/GKO3abZTU2K/structure.png?h=300&w=458 "2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid (3-acetyl-phenyl)-amide")
