| SpectraBase Spectrum ID |
4cWWeTOxr2I |
| Name |
(S,E)-Hept-4-en-3-yl-glycine methyl ester |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H19NO2 |
| InChI |
InChI=1S/C10H19NO2/c1-4-6-7-9(5-2)11-8-10(12)13-3/h6-7,9,11H,4-5,8H2,1-3H3/b7-6+/t9-/m0/s1 |
| InChIKey |
RZHKDKRBBOMEGK-UCUJLANTSA-N |
| Instrument Name |
Agilent 6890-5937 N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202000307 |
| Molecular Weight |
185.267 g/mol |
| Optical Rotation |
[a]D20 = -52.4 (436 nm), -32.2 (546 nm), -28.6 (579 nm), -27.6 (589 nm) (c = 0.939 g/100 ml, CHCl3) |
| SMILES |
N([C@](\C=C\CC)(CC)[H])CC(OC)=O |
| SPLASH |
splash10-0a4i-4900000000-359db9c740b97d79273e |
| Sample Comments |
er = 98:2 |
| Source of Spectrum |
QE-26-SM10-(S)-3b |
| Thin-Layer Chromatography |
Rf = 0.16 (Silica, cHex/EtOAc, 2:1) |
| Wiley ID |
1858588 |
