| SpectraBase Spectrum ID |
2sD2N7h4Nkz |
| Name |
4-Acetyl-1,3-benzoxazol-2(3H)-one, N-acetyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
219.053157770 u |
| Formula |
C11H9NO4 |
| InChI |
InChI=1S/C11H9NO4/c1-6(13)8-4-3-5-9-10(8)12(7(2)14)11(15)16-9/h3-5H,1-2H3 |
| InChIKey |
KSYIQJIZMZVGTI-UHFFFAOYSA-N |
| Molecular Weight |
219.196 g/mol |
| SMILES |
C1(OC=2C(N1C(C)=O)=C(C=CC2)C(=O)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873989 |
