| SpectraBase Spectrum ID |
Bj0FPcHFpb5 |
| Name |
3-Benzyl-5-isopropoxy-6-methoxy-3,4-dihydroisocoumarin |
| Appearance |
Colorless crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H22O4 |
| InChI |
InChI=1S/C20H22O4/c1-13(2)23-19-17-12-15(11-14-7-5-4-6-8-14)24-20(21)16(17)9-10-18(19)22-3/h4-10,13,15H,11-12H2,1-3H3 |
| InChIKey |
OBMQLNCAKFSNFF-UHFFFAOYSA-N |
| Instrument Name |
Hewlett Packard series II GC-MS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0014.310 |
| Molecular Weight |
326.392 g/mol |
| Reported Formula |
C20H22O4 |
| SMILES |
c1(ccccc1)CC1OC(c2c(C1)c(c(cc2)OC)OC(C)C)=O |
| SPLASH |
splash10-0909-0930000000-513a6bd3b59cc20ab46f |
| Source of Spectrum |
ARK-2013-126-4c |
| Thin-Layer Chromatography |
Rf = 0.32 (ethyl acetate/n-hexane, 1: 5) |
| Wiley ID |
1853477 |
