| SpectraBase Spectrum ID |
G0Iv9iFY5hu |
| Name |
Carbonic acid, 4-nitrophenyl phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
259.048072389 u |
| Formula |
C13H9NO5 |
| InChI |
InChI=1S/C13H9NO5/c15-13(18-11-4-2-1-3-5-11)19-12-8-6-10(7-9-12)14(16)17/h1-9H |
| InChIKey |
IICMBPLBSCZBTN-UHFFFAOYSA-N |
| Molecular Weight |
259.217 g/mol |
| SMILES |
C(OC1=CC=C(C=C1)N(=O)=O)(OC1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.978321 |
