| SpectraBase Spectrum ID |
6j9pNI1hQrP |
| Name |
1,1'-(m-Iodobenzylidene)di-2-naphthol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
502.042974850 u |
| Formula |
C27H19IO2 |
| InChI |
InChI=1S/C27H19IO2/c28-20-9-5-8-19(16-20)25(26-21-10-3-1-6-17(21)12-14-23(26)29)27-22-11-4-2-7-18(22)13-15-24(27)30/h1-16,25,29-30H |
| InChIKey |
BPERZJYNFBAFLZ-UHFFFAOYSA-N |
| Molecular Weight |
502.351 g/mol |
| SMILES |
OC=1C=CC=2C=CC=CC2C1C(C1=C(C=CC=2C=CC=CC12)O)C=1C=CC=C(C1)I |
| Spectrum/Structure Validation Score (Raman) |
0.947105 |
