| SpectraBase Spectrum ID |
5uREVlMJbKY |
| Name |
Spiro[tetrahydrofuran-2-one-5,4'-cyclohexadienone], 2',6'-diiodo- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
415.840634050 u |
| Formula |
C9H6I2O3 |
| InChI |
InChI=1S/C9H6I2O3/c10-5-3-9(2-1-7(12)14-9)4-6(11)8(5)13/h3-4H,1-2H2 |
| InChIKey |
DXVCCVPRGONGKZ-UHFFFAOYSA-N |
| Molecular Weight |
415.953 g/mol |
| SMILES |
C1=C(C(C(=CC11OC(=O)CC1)I)=O)I |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806145 |
![Spiro[tetrahydrofuran-2-one-5,4'-cyclohexadienone], 2',6'-diiodo-](/api/spectrum/5uREVlMJbKY/structure.png?h=300&w=458 "Spiro[tetrahydrofuran-2-one-5,4'-cyclohexadienone], 2',6'-diiodo-")
