| SpectraBase Spectrum ID |
JsOnyOT1Ljv |
| Name |
2-[(2S,3R)-1-(4-Methoxyphenyl)-5-oxo-3-phenylpyrrolidin-2-yl]cyclohexa-2,5-diene-1,4-dione |
| Appearance |
Red solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
373.131408092 u |
| Formula |
C23H19NO4 |
| InChI |
InChI=1S/C23H19NO4/c1-28-18-10-7-16(8-11-18)24-22(27)14-19(15-5-3-2-4-6-15)23(24)20-13-17(25)9-12-21(20)26/h2-13,19,23H,14H2,1H3/t19-,23+/m1/s1 |
| InChIKey |
MHFDUOYFDDYWDS-XXBNENTESA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201703263 |
| Molecular Weight |
373.408 g/mol |
| Optical Rotation |
[a]D20 = -45.4 (c = 2.33, CHCl3) |
| Reported Formula |
C23H19NO4 |
| SMILES |
COC1=CC=C(C=C1)N1[C@@]([C@](CC1=O)(C1=CC=CC=C1)[H])(C=1C(C=CC(C1)=O)=O)[H] |
| SPLASH |
splash10-00di-0009000000-2ce6e21d6db25352499f |
| Source of Spectrum |
QE-23-SM23-8 (DOI: 10.1002/chem.201703263) |
| Wiley ID |
1905946 |
![2-[(2S,3R)-1-(4-Methoxyphenyl)-5-oxo-3-phenylpyrrolidin-2-yl]cyclohexa-2,5-diene-1,4-dione](/api/spectrum/JsOnyOT1Ljv/structure.png?h=300&w=458 "2-[(2S,3R)-1-(4-Methoxyphenyl)-5-oxo-3-phenylpyrrolidin-2-yl]cyclohexa-2,5-diene-1,4-dione")
