| SpectraBase Spectrum ID |
9A0jF98ZkFR |
| Name |
4-Benzyl-6-chloro-2-methoxyisoquinolin-1(2H)-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
299.071306393 u |
| Formula |
C17H14ClNO2 |
| InChI |
InChI=1S/C17H14ClNO2/c1-21-19-11-13(9-12-5-3-2-4-6-12)16-10-14(18)7-8-15(16)17(19)20/h2-8,10-11H,9H2,1H3 |
| InChIKey |
SVHZVYJIRKMFKG-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ Finnigan 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201710776 |
| Molecular Weight |
299.757 g/mol |
| Quality |
187 |
| Reported Formula |
C17H14ClNO2 |
| SMILES |
C1(=CC=CC=C1)CC1=CN(C(C2=C1C=C(C=C2)Cl)=O)OC |
| SPLASH |
splash10-0fba-0982000000-cd9c0e610d9563b26756 |
| Source of Spectrum |
ACI-56-SM30-3ea (DOI: 10.1002/anie.201710776) |
| Thin-Layer Chromatography |
0.4 (pentane/EtOAc, 2:1) |
| Wiley ID |
1896657 |
