| SpectraBase Spectrum ID |
HsEFytel8J9 |
| Name |
9,10-Ethanoanthracene, 9,10-dihydro-2,3-diiodo- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
457.902840386 u |
| Formula |
C16H12I2 |
| InChI |
InChI=1S/C16H12I2/c17-15-7-13-11-5-6-12(14(13)8-16(15)18)10-4-2-1-3-9(10)11/h1-4,7-8,11-12H,5-6H2 |
| InChIKey |
ZWBXABQFFNEXHD-UHFFFAOYSA-N |
| Molecular Weight |
458.081 g/mol |
| SMILES |
C=12C(C3CCC2C2=C3C=CC=C2)=CC(=C(C1)I)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957258 |