| SpectraBase Spectrum ID |
6iLZpyaZwjg |
| Name |
1,1'-Biphenyl, 2,5-diiodo-3'-methoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
435.882104941 u |
| Formula |
C13H10I2O |
| InChI |
InChI=1S/C13H10I2O/c1-16-11-4-2-3-9(7-11)12-8-10(14)5-6-13(12)15/h2-8H,1H3 |
| InChIKey |
QNXUHNNSAMLQON-UHFFFAOYSA-N |
| Molecular Weight |
436.031 g/mol |
| SMILES |
C=1(C=2C=C(OC)C=CC2)C(=CC=C(C1)I)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902767 |
