| SpectraBase Spectrum ID |
IIuzmRwGOao |
| Name |
2-Iodomethyl-7-methoxy-8-(prop-2'-enyl)-2,3-dihydroanthra[1,2-B]furan-6,11-dione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
460.017154023 u |
| Formula |
C21H17IO4 |
| InChI |
InChI=1S/C21H17IO4/c1-3-4-11-5-7-14-16(20(11)25-2)18(23)15-8-6-12-9-13(10-22)26-21(12)17(15)19(14)24/h3-8,13H,9-10H2,1-2H3/b4-3+ |
| InChIKey |
AUPZCIRKPAQNQR-ONEGZZNKSA-N |
| Molecular Weight |
460.267 g/mol |
| SMILES |
C1=2C(C3=CC=C(C(=C3C(C2C=CC2=C1OC(CI)C2)=O)OC)\C=C\C)=O |