| SpectraBase Spectrum ID |
Bbvfx7dxXuA |
| Name |
4-n-Butyl-3-(4-methoxyphenyl)-8-methyl-1H-isochromen-1-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.156894565 u |
| Formula |
C21H22O3 |
| InChI |
InChI=1S/C21H22O3/c1-4-5-8-18-17-9-6-7-14(2)19(17)21(22)24-20(18)15-10-12-16(23-3)13-11-15/h6-7,9-13H,4-5,8H2,1-3H3 |
| InChIKey |
HRVBJVWFHFMNRP-UHFFFAOYSA-N |
| Instrument Name |
Jeol AccuTOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201802748 |
| Molecular Weight |
322.404 g/mol |
| Reported Formula |
C21H22O3 |
| SMILES |
C=1C=CC=2C(CCCC)=C(OC(=O)C2C1C)C1=CC=C(OC)C=C1 |
| SPLASH |
splash10-0udi-0092000000-77f247db8a4be16569b3 |
| Source of Spectrum |
ACI-57-SM17-3ak (DOI: 10.1002/anie.201802748) |
| Wiley ID |
1890947 |
