| SpectraBase Spectrum ID |
BT1QFFezkWv |
| Name |
(E)-Methyl 1-acetyl-2-(4-methoxybenzylidene)-5-phenylcyclopentanecarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
364.167459249 u |
| Formula |
C23H24O4 |
| InChI |
InChI=1S/C23H24O4/c1-16(24)23(22(25)27-3)19(15-17-9-12-20(26-2)13-10-17)11-14-21(23)18-7-5-4-6-8-18/h4-10,12-13,15,21H,11,14H2,1-3H3/b19-15+ |
| InChIKey |
QDOVOJSRWGNPDZ-XDJHFCHBSA-N |
| Molecular Weight |
364.441 g/mol |
| SMILES |
C1(\C(CCC1C1=CC=CC=C1)=C\C=1C=CC(=CC1)OC)(C(=O)OC)C(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946885 |
