| SpectraBase Spectrum ID |
3VHdx73yqp6 |
| Name |
Trans-1-cyclohexyl-2-[p-(dimethylamino)phenyl]-5-oxo-3-pyrrolidinecarboxylic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
330.194342702 u |
| Formula |
C19H26N2O3 |
| InChI |
InChI=1S/C19H26N2O3/c1-20(2)14-10-8-13(9-11-14)18-16(19(23)24)12-17(22)21(18)15-6-4-3-5-7-15/h8-11,15-16,18H,3-7,12H2,1-2H3,(H,23,24)/t16-,18+/m0/s1 |
| InChIKey |
GMWXDIURKWZOLT-FUHWJXTLSA-N |
| Molecular Weight |
330.428 g/mol |
| SMILES |
OC([C@@]1([C@](N(C(C1)=O)C1CCCCC1)(C=1C=CC(=CC1)N(C)C)[H])[H])=O |
| Spectrum/Structure Validation Score (Raman) |
0.933764 |
![Trans-1-cyclohexyl-2-[p-(dimethylamino)phenyl]-5-oxo-3-pyrrolidinecarboxylic acid](/api/spectrum/3VHdx73yqp6/structure.png?h=300&w=458 "Trans-1-cyclohexyl-2-[p-(dimethylamino)phenyl]-5-oxo-3-pyrrolidinecarboxylic acid")
