| SpectraBase Spectrum ID |
8W25GsnAK22 |
| Name |
2-(2-Bromo-4,5-methylenedioxyphenethyl)-7,8-dimethoxy-4-(methylthio)-1,2,3,4-tetrahydroisoquinolin-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22BrNO5S |
| InChI |
InChI=1S/C21H22BrNO5S/c1-25-16-5-4-13-14(19(16)26-2)10-23(21(24)20(13)29-3)7-6-12-8-17-18(9-15(12)22)28-11-27-17/h4-5,8-9,20H,6-7,10-11H2,1-3H3 |
| InChIKey |
VBDYDECDYBDCHG-UHFFFAOYSA-N |
| Molecular Weight |
480.373 g/mol |
| SMILES |
C1N(C(C(c2ccc(c(c12)OC)OC)SC)=O)CCc1c(cc2c(c1)OCO2)Br |
| SPLASH |
splash10-0pb9-0491100000-8105a11a2856806ed6c0 |
| Source of Spectrum |
E2-48-403-14 |
| Synonyms |
2-[2-(6-bromo-1,3-benzodioxol-5-yl)ethyl]-7,8-dimethoxy-4-(methylsulfanyl)-1,4-dihydro-3(2H)-isoquinolinone |
| Wiley ID |
1555081 |
