| SpectraBase Spectrum ID |
DMcXh2a4kS3 |
| Name |
7-Benzyloxy-2-hydroxy-2H-1,4-benzoxazin-3(4H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
271.084457899 u |
| Formula |
C15H13NO4 |
| InChI |
InChI=1S/C15H13NO4/c17-14-15(18)20-13-8-11(6-7-12(13)16-14)19-9-10-4-2-1-3-5-10/h1-8,15,18H,9H2,(H,16,17) |
| InChIKey |
ZJXPCLANEMSWBG-UHFFFAOYSA-N |
| SMILES |
C1(OCC2=CC=CC=C2)=CC=C2NC(C(OC2=C1)O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942319 |