| SpectraBase Spectrum ID |
EwVhn22SWtU |
| Name |
3-heptyl-2H-isoquinolin-1-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
243.162314299 u |
| Formula |
C16H21NO |
| InChI |
InChI=1S/C16H21NO/c1-2-3-4-5-6-10-14-12-13-9-7-8-11-15(13)16(18)17-14/h7-9,11-12H,2-6,10H2,1H3,(H,17,18) |
| InChIKey |
NMKFZSHUOXTJJF-UHFFFAOYSA-N |
| Instrument Name |
Jeol AccuTOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201801324 |
| Molecular Weight |
243.350 g/mol |
| Quality |
146 |
| Reported Formula |
C16H21NO |
| SMILES |
N1C(=CC=2C=CC=CC2C1=O)CCCCCCC |
| SPLASH |
splash10-0a4l-2930000000-e6b463e971ebe858735e |
| Source of Spectrum |
ACI-57-SM32-10 (DOI: 10.1002/anie.201801324) |
| Wiley ID |
1891063 |
