| SpectraBase Spectrum ID |
8vZO4tUQYzM |
| Name |
5-Hydroxy-2-iodomethyl-2,3-dihydroanthra[1,2-A]furan-6,11-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.970203830 u |
| Formula |
C17H11IO4 |
| InChI |
InChI=1S/C17H11IO4/c18-7-9-5-8-6-12(19)13-14(17(8)22-9)16(21)11-4-2-1-3-10(11)15(13)20/h1-4,6,9,19H,5,7H2 |
| InChIKey |
PTEGKBOIDDKEBK-UHFFFAOYSA-N |
| Molecular Weight |
406.175 g/mol |
| SMILES |
C12=C(C(=O)C=3C(C2=O)=CC=CC3)C(O)=CC2=C1OC(CI)C2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90777 |
![5-Hydroxy-2-iodomethyl-2,3-dihydroanthra[1,2-A]furan-6,11-dione](/api/spectrum/8vZO4tUQYzM/structure.png?h=300&w=458 "5-Hydroxy-2-iodomethyl-2,3-dihydroanthra[1,2-A]furan-6,11-dione")
