| SpectraBase Spectrum ID |
1TzoemzTVrJ |
| Name |
6(2H)-Isoquinolinone, octahydro-2-methyl-4a-phenyl-, cis- |
| CAS Registry Number |
50640-74-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21NO |
| InChI |
InChI=1S/C16H21NO/c1-17-10-9-16(13-5-3-2-4-6-13)11-15(18)8-7-14(16)12-17/h2-6,14H,7-12H2,1H3/t14-,16-/m0/s1 |
| InChIKey |
FFBSKTNIGLGNQP-HOCLYGCPSA-N |
| Molecular Weight |
243.350 g/mol |
| SMILES |
[C@]12([C@](CN(CC2)C)(CCC(C1)=O)[H])c1ccccc1 |
| SPLASH |
splash10-0006-8090000000-d288b61604ac6de5f92a |
| Source of Spectrum |
C-98-6657-0 |
| Wiley ID |
1246235 |
