| SpectraBase Spectrum ID |
Be4QBezIxZv |
| Name |
1-(tert-butyl) 2-methyl (2S,4S)-4-cyanopyrrolidine-1,2-dicarboxylate |
| Appearance |
Colorless solid |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18N2O4 |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C12H18N2O4/c1-12(2,3)18-11(16)14-7-8(6-13)5-9(14)10(15)17-4/h8-9H,5,7H2,1-4H3/t8-,9+/m1/s1 |
| InChIKey |
GHLKJIQVORAVHE-BDAKNGLRSA-N |
| Instrument Name |
Agilent HP6890-5937N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/cbic.202200372 |
| Molecular Weight |
254.286 g/mol |
| Optical Rotation |
[a]D20 = -30.73 (c = 0.665, CHCl3) |
| SMILES |
[C@]1(N(C[C@](C1)(C#N)[H])C(=O)OC(C)(C)C)(C(=O)OC)[H] |
| SPLASH |
splash10-0a4j-9200000000-3923877b5f9ecfc4799a |
| Source of Spectrum |
CBC-23-SM4-6 |
| Thin-Layer Chromatography |
Rf = 0.31 (SiO2, EtOAc/cHex, 1:2) |
| Wiley ID |
1876084 |
