| SpectraBase Spectrum ID |
DVuFKo1rIVn |
| Name |
Benzoic acid, 1-(2-tert-butyl-1-methyl-5-oxo-imidazolidin-4-yl)-2-methylpropyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.225642831 u |
| Formula |
C19H30N2O3 |
| InChI |
InChI=1S/C11H14O2.C8H16N2O/c1-9(2)8-13-11(12)10-6-4-3-5-7-10;1-8(2,3)7-9-5-6(11)10(7)4/h3-7,9H,8H2,1-2H3;7,9H,5H2,1-4H3 |
| InChIKey |
PNBJCGYMGYKDQN-UHFFFAOYSA-N |
| Molecular Weight |
334.460 g/mol |
| Nominal Mass |
334 u |
| SMILES |
N1C(N(C(C1)=O)C)C(C)(C)C.c1(ccccc1)C(=O)OCC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.835849 |
