| SpectraBase Spectrum ID |
DfED1MAf95I |
| Name |
3-Cyclopentene-1,3-dicarboxylic acid, 2-oxo-4,5-diphenyl-, dimethyl ester, trans- |
| Alternate Name(s) |
dimethyl (1R,5S)-2-oxo-4,5-diphenyl-3-cyclopentene-1,3-dicarboxylate
Dimethyl 5-oxo-2,3-diphenylcyclopentene-1,4-dicarboxylate |
| CAS Registry Number |
85357-65-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H18O5 |
| InChI |
InChI=1S/C21H18O5/c1-25-20(23)17-15(13-9-5-3-6-10-13)16(14-11-7-4-8-12-14)18(19(17)22)21(24)26-2/h3-12,15,17H,1-2H3/t15-,17+/m0/s1 |
| InChIKey |
KOVBWHCPCMGHKF-DOTOQJQBSA-N |
| Molecular Weight |
350.370 g/mol |
| SMILES |
C1(=C([C@](c2ccccc2)([C@](C1=O)(C(=O)OC)[H])[H])c1ccccc1)C(=O)OC |
| SPLASH |
splash10-014i-0009000000-ae3e9518202a56dfd642 |
| Source of Spectrum |
AJ-56-178-15 |
| Wiley ID |
1342050 |
