| SpectraBase Spectrum ID |
IghoAjMx6cc |
| Name |
8-(R-6'-Hydroperoxy-3',7'-dimethylocta-2',7'-dienyloxy)-psoralen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22O6 |
| InChI |
InChI=1S/C21H22O6/c1-13(2)17(27-23)6-4-14(3)8-10-25-21-19-16(9-11-24-19)12-15-5-7-18(22)26-20(15)21/h5,7-9,11-12,17,23H,1,4,6,10H2,2-3H3/b14-8+/t17-/m1/s1 |
| InChIKey |
ILYZUSHBLPOZIC-LEHPZIBWSA-N |
| Molecular Weight |
370.401 g/mol |
| SMILES |
OO[C@@](C(=C)C)(CC\C(=C\COc1c2OC(=O)C=Cc2cc2ccoc12)C)[H] |
| SPLASH |
splash10-0udi-2890000000-6df5145c8f40bf65b5e2 |
| Source of Spectrum |
X2-55-857-16 |
| Synonyms |
8-(6'-Hydroperoxy-3',7'-dimethylocta-2',7'-dienyloxy)-psoralen
9-{[(2E,6R)-6-hydroperoxy-3,7-dimethyl-2,7-octadienyl]oxy}-7H-furo[3,2-g]chromen-7-one |
| Wiley ID |
1604527 |
