| SpectraBase Spectrum ID |
Jg78qcvwnhX |
| Name |
4-Imidazolidinepropanoic acid, 3-benzoyl-2-(1,1-dimethylethyl)-1,4-dimethyl-5-oxo-, (2S-cis)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.189257321 u |
| Formula |
C19H26N2O4 |
| InChI |
InChI=1S/C19H26N2O4/c1-18(2,3)16-20(5)17(25)19(4,12-11-14(22)23)21(16)15(24)13-9-7-6-8-10-13/h6-10,16H,11-12H2,1-5H3,(H,22,23) |
| InChIKey |
JCRXINIPPSXFEX-UHFFFAOYSA-N |
| Molecular Weight |
346.427 g/mol |
| SMILES |
CC(C)(C)C1N(C(=O)C=2C=CC=CC2)C(C(N1C)=O)(C)CCC(O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938554 |
