| SpectraBase Spectrum ID |
5VZFa2ItZQ2 |
| Name |
4-Benzylisoquinolin-1(2H)-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
235.099714042 u |
| Formula |
C16H13NO |
| InChI |
InChI=1S/C16H13NO/c18-16-15-9-5-4-8-14(15)13(11-17-16)10-12-6-2-1-3-7-12/h1-9,11H,10H2,(H,17,18) |
| InChIKey |
SPSFKUNCYSHNOA-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ Finnigan 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201710776 |
| Molecular Weight |
235.286 g/mol |
| Quality |
174 |
| Reported Formula |
C16H13NO |
| SMILES |
N1C(C2=C(C(=C1)CC1=CC=CC=C1)C=CC=C2)=O |
| SPLASH |
splash10-0019-5690000000-f31d46b4419344136417 |
| Source of Spectrum |
ACI-56-SM55-7 (DOI: 10.1002/anie.201710776) |
| Thin-Layer Chromatography |
0.3 (pentane/EtOAc, 1:1) |
| Wiley ID |
1896690 |
