| SpectraBase Spectrum ID |
mbujisZsgR |
| Name |
Diethyl-2-[3-(3-methoxyphenyl)-1-phenyl-3-oxopropyl]-malonate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.172938551 u |
| Formula |
C23H26O6 |
| InChI |
InChI=1S/C23H26O6/c1-4-28-22(25)21(23(26)29-5-2)19(16-10-7-6-8-11-16)15-20(24)17-12-9-13-18(14-17)27-3/h6-14,19,21H,4-5,15H2,1-3H3 |
| InChIKey |
ONMUFYHHTHCFGP-UHFFFAOYSA-N |
| Molecular Weight |
398.455 g/mol |
| SMILES |
C(C(CC(C=1C=C(OC)C=CC1)=O)C=1C=CC=CC1)(C(=O)OCC)C(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933341 |
![Diethyl-2-[3-(3-methoxyphenyl)-1-phenyl-3-oxopropyl]-malonate](/api/spectrum/mbujisZsgR/structure.png?h=300&w=458 "Diethyl-2-[3-(3-methoxyphenyl)-1-phenyl-3-oxopropyl]-malonate")
