| SpectraBase Spectrum ID |
5fKWkkPskuP |
| Name |
N-(6-(Propa-1,2-dien-1-yl)benzo[D][1,3]dioxol-5-yl)benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
279.089543280 u |
| Formula |
C17H13NO3 |
| InChI |
InChI=1S/C17H13NO3/c1-2-6-13-9-15-16(21-11-20-15)10-14(13)18-17(19)12-7-4-3-5-8-12/h3-10H,1,11H2,(H,18,19) |
| InChIKey |
YISVTQWPYLLVED-UHFFFAOYSA-N |
| Molecular Weight |
279.295 g/mol |
| SMILES |
C1=C(NC(C2=CC=CC=C2)=O)C(C=C=C)=CC2=C1OCO2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958323 |