| SpectraBase Spectrum ID |
4sNdXLliDr5 |
| Name |
Phenol, 4-[(2-hydroxy-5-methylphenyl)methyl]-2,6-dinitro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.069536108 u |
| Formula |
C14H12N2O6 |
| InChI |
InChI=1S/C14H12N2O6/c1-8-2-3-13(17)10(4-8)5-9-6-11(15(19)20)14(18)12(7-9)16(21)22/h2-4,6-7,17-18H,5H2,1H3 |
| InChIKey |
WAJVAVZYITUNEZ-UHFFFAOYSA-N |
| Molecular Weight |
304.258 g/mol |
| SMILES |
C=1(C(=C(N(=O)=O)C=C(C1)CC=1C(=CC=C(C1)C)O)O)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935136 |
![Phenol, 4-[(2-hydroxy-5-methylphenyl)methyl]-2,6-dinitro-](/api/spectrum/4sNdXLliDr5/structure.png?h=300&w=458 "Phenol, 4-[(2-hydroxy-5-methylphenyl)methyl]-2,6-dinitro-")
