| SpectraBase Spectrum ID |
Do3Ibaf4awq |
| Name |
tert-Butyl-4-[(2-methylphenyl)(thiophene-3-carbonyl)amino]piperidine-1-carboxylate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
400.182063941 u |
| Formula |
C22H28N2O3S |
| InChI |
InChI=1S/C22H28N2O3S/c1-16-7-5-6-8-19(16)24(20(25)17-11-14-28-15-17)18-9-12-23(13-10-18)21(26)27-22(2,3)4/h5-8,11,14-15,18H,9-10,12-13H2,1-4H3 |
| InChIKey |
FRPMKFNHNDBKFE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
400.537 g/mol |
| Nominal Mass |
400 u |
| Quality |
995 |
| Retention Index |
3042 |
| SMILES |
C=1(N(C2CCN(C(OC(C)(C)C)=O)CC2)C(C=2C=CSC2)=O)C(=CC=CC1)C |
| SPLASH |
splash10-07do-9420100000-01c4ce1c6bb438ded277 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029007 |
![tert-Butyl-4-[(2-methylphenyl)(thiophene-3-carbonyl)amino]piperidine-1-carboxylate](/api/spectrum/Do3Ibaf4awq/structure.png?h=300&w=458 "tert-Butyl-4-[(2-methylphenyl)(thiophene-3-carbonyl)amino]piperidine-1-carboxylate")
