| SpectraBase Spectrum ID |
F0w43MO0Fim |
| Name |
Pentanedioic acid, 2,4-diacetyl-3-phenyl-, diethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.157288487 u |
| Formula |
C19H24O6 |
| InChI |
InChI=1S/C19H24O6/c1-5-24-18(22)15(12(3)20)17(14-10-8-7-9-11-14)16(13(4)21)19(23)25-6-2/h7-11,15-17H,5-6H2,1-4H3 |
| InChIKey |
VJDMHFPDRYFKOU-UHFFFAOYSA-N |
| Molecular Weight |
348.395 g/mol |
| SMILES |
C(OC(C(C(C(C(OCC)=O)C(=O)C)C1=CC=CC=C1)C(=O)C)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.985148 |
