| SpectraBase Spectrum ID |
BHei6RvqmFk |
| Name |
2-(5-Oxo-5-(2-oxo-7a-phenyl-2,4,5,6,7,7a-hexahydro-1H-indol-3-yl)pentyl)isoindoline-1,3-dione |
| Appearance |
White crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
442.189257321 u |
| Formula |
C27H26N2O4 |
| InChI |
InChI=1S/C27H26N2O4/c30-22(15-7-9-17-29-25(32)19-12-4-5-13-20(19)26(29)33)23-21-14-6-8-16-27(21,28-24(23)31)18-10-2-1-3-11-18/h1-5,10-13H,6-9,14-17H2,(H,28,31) |
| InChIKey |
RPFWKNKCOCPLKA-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS QP2010SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.2c02935 |
| Molecular Weight |
442.515 g/mol |
| Quality |
145 |
| Reported Formula |
C27H26N2O4 |
| SMILES |
N1C(C(=C2C1(CCCC2)C1=CC=CC=C1)C(CCCCN1C(C2=C(C1=O)C=CC=C2)=O)=O)=O |
| SPLASH |
splash10-03di-0690200000-8efd22ed2382d1fb0ed2 |
| Source of Spectrum |
JOC-88-3961-4aq (DOI: 10.1021/acs.joc.2c02935) |
| Wiley ID |
1912715 |
