| SpectraBase Spectrum ID |
3pf9yxnNxsu |
| Name |
7-Hydroxy-4-methyl-6,8-dinitrocoumarin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.017500534 u |
| Formula |
C10H6N2O7 |
| InChI |
InChI=1S/C10H6N2O7/c1-4-2-7(13)19-10-5(4)3-6(11(15)16)9(14)8(10)12(17)18/h2-3,14H,1H3 |
| InChIKey |
MXBXJWTYFYICFE-UHFFFAOYSA-N |
| Molecular Weight |
266.165 g/mol |
| SMILES |
C1(=C(C(N(=O)=O)=CC2=C1OC(C=C2C)=O)O)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.833683 |
