| SpectraBase Spectrum ID |
KHPFPbBAtYk |
| Name |
2-(2-Dimethylamino-N-(2,3-dimethyl-5-oxo-1-phenyl-3-pyrazolin-4-yl)acetamido)-N,N-dimethylpropionamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
387.227039811 u |
| Formula |
C20H29N5O3 |
| InChI |
InChI=1S/C20H29N5O3/c1-13(19(27)23(5)6)21-18(26)17(22(3)4)16-14(2)24(7)25(20(16)28)15-11-9-8-10-12-15/h8-13,17H,1-7H3,(H,21,26) |
| InChIKey |
KDFKVTJWBIILKJ-UHFFFAOYSA-N |
| Molecular Weight |
387.484 g/mol |
| SMILES |
C=1(C(C(=O)NC(C(N(C)C)=O)C)N(C)C)C(N(C2=CC=CC=C2)N(C1C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944349 |
