| SpectraBase Spectrum ID |
ERCfbPf6qbj |
| Name |
trans-Ethyl 1-(tert-butyl)-3,4-dicyanopyrrolidine-2-carboxylate |
| Appearance |
Yellowish oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
249.147726862 u |
| Formula |
C13H19N3O2 |
| InChI |
InChI=1S/C13H19N3O2/c1-5-18-12(17)11-10(7-15)9(6-14)8-16(11)13(2,3)4/h9-11H,5,8H2,1-4H3 |
| InChIKey |
KERHHGDMWCNJMF-UHFFFAOYSA-N |
| Instrument Name |
FISONS INSTRUMENTS TRIO 1000 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.3998/ark.5550190.0002.517 |
| Molecular Weight |
249.314 g/mol |
| Quality |
246 |
| SMILES |
C(C)OC(=O)C1N(CC(C1C#N)C#N)C(C)(C)C |
| SPLASH |
splash10-0a4i-9430000000-4e7ec75196529272c846 |
| Sample Comments |
2,3-trans isomer |
| Source of Spectrum |
ARK-2001-160-trans-4b (DOI: 10.3998/ark.5550190.0002.517) |
| Wiley ID |
1908770 |
