| SpectraBase Spectrum ID |
3sd3WTUNHTf |
| Name |
tert-butyl (2S)-1-[(E)-5-methylhex-2-enyl]pyrrolidine-2-carboxylate |
| Appearance |
Colorless oil |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
267.219829176 u |
| Formula |
C16H29NO2 |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C16H29NO2/c1-13(2)9-6-7-11-17-12-8-10-14(17)15(18)19-16(3,4)5/h6-7,13-14H,8-12H2,1-5H3/b7-6+/t14-/m0/s1 |
| InChIKey |
BKNPFVOZRVKRSG-UZYOAWRESA-N |
| Instrument Name |
Agilent HP6890-5937 N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202200188 |
| Molecular Weight |
267.413 g/mol |
| Optical Rotation |
[a]D20 = -239 (365 nm), -92.6 (436 nm), -48.4 (546 nm), -39.5 (579 nm), -34.4 (589 nm) (c = 0.08 g/100 mL, CHCl3) |
| Quality |
63 |
| SMILES |
CC(C\C=C\CN1[C@](C(=O)OC(C)(C)C)(CCC1)[H])C |
| SPLASH |
splash10-014i-3900000000-87bee83973d12697d441 |
| Source of Spectrum |
K1-2022-SM78-E,S-11f (DOI: 10.1002/ejoc.202200188) |
| Thin-Layer Chromatography |
0.20 (SiO2, CyHex/EtOAc, 5:1) |
| Wiley ID |
1898505 |
![tert-butyl (2S)-1-[(E)-5-methylhex-2-enyl]pyrrolidine-2-carboxylate](/api/spectrum/3sd3WTUNHTf/structure.png?h=300&w=458 "tert-butyl (2S)-1-[(E)-5-methylhex-2-enyl]pyrrolidine-2-carboxylate")
