| SpectraBase Spectrum ID |
Ln9EK8DE6Xg |
| Name |
2,2-Dimethylpropanoic acid 2-[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.199093730 u |
| Formula |
C18H27NO3 |
| InChI |
InChI=1S/C18H27NO3/c1-17(2,3)15(20)19-14-9-7-13(8-10-14)11-12-22-16(21)18(4,5)6/h7-10H,11-12H2,1-6H3,(H,19,20) |
| InChIKey |
UTTSIFIJWMVYQI-UHFFFAOYSA-N |
| Molecular Weight |
305.418 g/mol |
| SMILES |
C(NC=1C=CC(=CC1)CCOC(C(C)(C)C)=O)(C(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889351 |
![2,2-Dimethylpropanoic acid 2-[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]ethyl ester](/api/spectrum/Ln9EK8DE6Xg/structure.png?h=300&w=458 "2,2-Dimethylpropanoic acid 2-[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]ethyl ester")
