Systematic / IUPAC Name: Ethyl 1-{[2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-4-yl]carbonyl}-3-piperidinecarboxylate
ID: Reference3535
Other Names: Ethyl 1-{[2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-4-yl]carbonyl}piperidine-3-carboxylate
Formula: C20H22N2O4S
Ethyl 1-{[2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-4-yl]carbonyl}-3-piperidinecarboxylate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Elite; Q Exactive Orbitrap |
No. of Spectral Trees | 2 |
No. of Spectra | 2647 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5, MS6, MS7 |
Ionization Methods | ESI; NSI |
Analyzers | IT; FT |
Last Modification | 1/11/2016 2:24:47 PM |
InChI | InChI=1S/C20H22N2O4S/c1-2-25-20(24)15-4-3-8-22(11-15)19(23)16-12-27-18(21-16)14-5-6-17-13(10-14)7-9-26-17/h5-6,10,12,15H,2-4,7-9,11H2,1H3 |
InChI Key | PGGICYAIOOLWRL-UHFFFAOYSA-N |
Canonical SMILES | CCOC(=O)C1CCCN(C1)C(=O)C2=CSC(=N2)C3=CC4=C(C=C3)OCC4 |
CAS | |
Splash | |
Other Names | Ethyl 1-{[2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-4-yl]carbonyl}piperidine-3-carboxylate |
PubChem | 2813334 |
ChEMBL | CHEMBL1611317 |
ChemSpider | 2091735 |