SpectraBase Spectrum ID |
H7t4qzjE0uO |
Name |
E-3-but-2-Enoylbenzo[D]oxazol-2(3H)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
203.058243151 u |
Formula |
C11H9NO3 |
InChI |
InChI=1S/C11H9NO3/c1-2-5-10(13)12-8-6-3-4-7-9(8)15-11(12)14/h2-7H,1H3/b5-2+ |
InChIKey |
DQMSQRPMEYYXIJ-GORDUTHDSA-N |
Molecular Weight |
203.197 g/mol |
SMILES |
C1(N(C=2C(O1)=CC=CC2)C(\C=C\C)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922642 |