| SpectraBase Spectrum ID |
HMEm2TqQLK4 |
| Name |
1-Iodo-4-nitro-2-phenoxybenzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.954888119 u |
| Formula |
C12H8INO3 |
| InChI |
InChI=1S/C12H8INO3/c13-11-7-6-9(14(15)16)8-12(11)17-10-4-2-1-3-5-10/h1-8H |
| InChIKey |
FSIOHGOJDXHALQ-UHFFFAOYSA-N |
| Molecular Weight |
341.104 g/mol |
| SMILES |
C=1C(=C(C=C(C1)[N+](=O)[O-])OC1=CC=CC=C1)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.865618 |
