SpectraBase Spectrum ID |
60fAQZywbBS |
Name |
4-(2-Chloroacetamido)-N-((2,3-dihydrobenzo[B][1,4]dioxin-2-yl)methyl)benzamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
360.087684731 u |
Formula |
C18H17ClN2O4 |
InChI |
InChI=1S/C18H17ClN2O4/c19-9-17(22)21-13-7-5-12(6-8-13)18(23)20-10-14-11-24-15-3-1-2-4-16(15)25-14/h1-8,14H,9-11H2,(H,20,23)(H,21,22) |
InChIKey |
DTJGFDZEEHLTPQ-UHFFFAOYSA-N |
Molecular Weight |
360.797 g/mol |
SMILES |
C(C1=CC=C(C=C1)NC(CCl)=O)(=O)NCC1OC2=C(OC1)C=CC=C2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917885 |