| SpectraBase Spectrum ID |
17SxL3NSlHF |
| Name |
3-Benzoyl-7a-phenyl-1,4,5,6,7,7a-hexahydro-2H-indol-2-one |
| Appearance |
White crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
317.141578854 u |
| Formula |
C21H19NO2 |
| InChI |
InChI=1S/C21H19NO2/c23-19(15-9-3-1-4-10-15)18-17-13-7-8-14-21(17,22-20(18)24)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H,22,24) |
| InChIKey |
LWXFWNAEIUHGAC-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS QP2010SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.2c02935 |
| Quality |
163 |
| Reported Formula |
C21H19NO2 |
| SMILES |
N1C(C(=C2C1(CCCC2)C1=CC=CC=C1)C(C1=CC=CC=C1)=O)=O |
| SPLASH |
splash10-0a4i-3943000000-305bfd241f45519e1d89 |
| Source of Spectrum |
JOC-88-3958-4aa (DOI: 10.1021/acs.joc.2c02935) |
| Wiley ID |
1912698 |
