| SpectraBase Spectrum ID |
1xs2I4Nd78s |
| Name |
Pyrrolidine-1-carboxylic acid, 2-cycloheptylaminocarbonyl-, phenyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
330.194342702 u |
| Formula |
C19H26N2O3 |
| InChI |
InChI=1S/C19H26N2O3/c22-18(20-15-9-4-1-2-5-10-15)17-13-8-14-21(17)19(23)24-16-11-6-3-7-12-16/h3,6-7,11-12,15,17H,1-2,4-5,8-10,13-14H2,(H,20,22) |
| InChIKey |
IIOIHEACRSWMBU-UHFFFAOYSA-N |
| Molecular Weight |
330.428 g/mol |
| SMILES |
C(N1C(C(NC2CCCCCC2)=O)CCC1)(OC=1C=CC=CC1)=O |