| SpectraBase Spectrum ID |
Jc2Q2PjNgms |
| Name |
4-(chlorobutyl)-2-methoxyisoquinolin-1(2H)-one |
| Appearance |
Pale yellow oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
265.086956457 u |
| Formula |
C14H16ClNO2 |
| InChI |
InChI=1S/C14H16ClNO2/c1-18-16-10-11(6-4-5-9-15)12-7-2-3-8-13(12)14(16)17/h2-3,7-8,10H,4-6,9H2,1H3 |
| InChIKey |
AMXRBWSRRFPPQH-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ Finnigan 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201710776 |
| Molecular Weight |
265.740 g/mol |
| Quality |
64 |
| Reported Formula |
C14H16NO2Cl |
| SMILES |
C(CC1=CN(C(C2=C1C=CC=C2)=O)OC)CCCl |
| SPLASH |
splash10-000i-0930000000-f80dca812f125d1ad247 |
| Source of Spectrum |
ACI-56-SM38-3ai (DOI: 10.1002/anie.201710776) |
| Thin-Layer Chromatography |
0.3 (pentane/EtOAc, 2:1) |
| Wiley ID |
1896653 |
