| SpectraBase Spectrum ID |
DAiejYlc2fD |
| Name |
Propanedioic acid, methyl[4-(2-methylpropyl)phenyl]-, diethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.183109313 u |
| Formula |
C18H26O4 |
| InChI |
InChI=1S/C18H26O4/c1-6-21-16(19)18(5,17(20)22-7-2)15-10-8-14(9-11-15)12-13(3)4/h8-11,13H,6-7,12H2,1-5H3 |
| InChIKey |
FYHWANSPTNLYKZ-UHFFFAOYSA-N |
| Molecular Weight |
306.402 g/mol |
| SMILES |
C(C(=O)OCC)(C(=O)OCC)(C=1C=CC(=CC1)CC(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916853 |
![Propanedioic acid, methyl[4-(2-methylpropyl)phenyl]-, diethyl ester](/api/spectrum/DAiejYlc2fD/structure.png?h=300&w=458 "Propanedioic acid, methyl[4-(2-methylpropyl)phenyl]-, diethyl ester")
