| SpectraBase Spectrum ID |
KkzXLcAwme5 |
| Name |
3-Benzoyl-8a-phenyl-4,5,6,7,8,8a-hexahydrocyclohepta[b]-pyrrol-2(1H)-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.157228918 u |
| Formula |
C22H21NO2 |
| InChI |
InChI=1S/C22H21NO2/c24-20(16-10-4-1-5-11-16)19-18-14-8-3-9-15-22(18,23-21(19)25)17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2,(H,23,25) |
| InChIKey |
AXUYQTABOXHFBD-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS QP2010SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.2c02935 |
| Molecular Weight |
331.415 g/mol |
| Quality |
131 |
| Reported Formula |
C22H21NO2 |
| SMILES |
N1C(C(=C2C1(CCCCC2)C1=CC=CC=C1)C(C1=CC=CC=C1)=O)=O |
| SPLASH |
splash10-0a7i-3934000000-707a454e70764bc5ae8f |
| Source of Spectrum |
JOC-88-3959-4ia (DOI: 10.1021/acs.joc.2c02935) |
| Wiley ID |
1912726 |
![3-Benzoyl-8a-phenyl-4,5,6,7,8,8a-hexahydrocyclohepta[b]-pyrrol-2(1H)-one](/api/spectrum/KkzXLcAwme5/structure.png?h=300&w=458 "3-Benzoyl-8a-phenyl-4,5,6,7,8,8a-hexahydrocyclohepta[b]-pyrrol-2(1H)-one")
