| SpectraBase Spectrum ID |
3Q8dK4rZ3W8 |
| Name |
4-Imidazolidinone, 1-benzoyl-2-(1,1-dimethylethyl)-3,5-dimethyl-5-(1-methyl-2-nitroethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
361.200156357 u |
| Formula |
C19H27N3O4 |
| InChI |
InChI=1S/C19H27N3O4/c1-13(12-22(25)26)18(5)16(24)21(6)19(20-18,17(2,3)4)15(23)14-10-8-7-9-11-14/h7-11,13,20H,12H2,1-6H3/t13?,18-,19+/m0/s1 |
| InChIKey |
UIPRWWNXUSHGEK-WFELRXAXSA-N |
| Molecular Weight |
361.442 g/mol |
| SMILES |
[C@@]1(N(C(=O)[C@@](N1)(C(CN(=O)=O)C)C)C)(C(=O)C1=CC=CC=C1)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929776 |
