| SpectraBase Spectrum ID |
m9kyAGy1zk |
| Name |
tert-Butyl-4-[(2-fluorophenyl)(thiophene-3-carbonyl)amino]piperidine-1-carboxylate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
404.156992007 u |
| Formula |
C21H25FN2O3S |
| InChI |
InChI=1S/C21H25FN2O3S/c1-21(2,3)27-20(26)23-11-8-16(9-12-23)24(18-7-5-4-6-17(18)22)19(25)15-10-13-28-14-15/h4-7,10,13-14,16H,8-9,11-12H2,1-3H3 |
| InChIKey |
ZABNRQNEFRTMNP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
404.500 g/mol |
| Nominal Mass |
404 u |
| Quality |
996 |
| Retention Index |
2950 |
| SMILES |
C=1(N(C2CCN(C(OC(C)(C)C)=O)CC2)C(C=2C=CSC2)=O)C(=CC=CC1)F |
| SPLASH |
splash10-0m06-9830000000-892ed98006076adf4dbc |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_028999 |
![tert-Butyl-4-[(2-fluorophenyl)(thiophene-3-carbonyl)amino]piperidine-1-carboxylate](/api/spectrum/m9kyAGy1zk/structure.png?h=300&w=458 "tert-Butyl-4-[(2-fluorophenyl)(thiophene-3-carbonyl)amino]piperidine-1-carboxylate")
