| SpectraBase Spectrum ID |
DoXEaHk51gu |
| Name |
tert-Butyl-4-[(3-fluorophenyl)(thiophene-2-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)23-11-9-16(10-12-23)24(17-7-4-6-15(22)14-17)19(25)18-8-5-13-28-18/h4-8,13-14,16H,9-12H2,1-3H3 |
| InChIKey |
IBLMXLMILTVIQY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
404.500 g/mol |
| Nominal Mass |
404 u |
| Quality |
1000 |
| Retention Index |
2925 |
| SMILES |
C1(N(C(C=2SC=CC2)=O)C2=CC(=CC=C2)F)CCN(C(OC(C)(C)C)=O)CC1 |
| SPLASH |
splash10-06tf-9710000000-780ebe271fe21e3730cc |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_028992 |
![tert-Butyl-4-[(3-fluorophenyl)(thiophene-2-carbonyl)amino]piperidine-1-carboxylate](/api/spectrum/DoXEaHk51gu/structure.png?h=300&w=458 "tert-Butyl-4-[(3-fluorophenyl)(thiophene-2-carbonyl)amino]piperidine-1-carboxylate")
