SpectraBase Spectrum ID |
ErkZ3k8XiTf |
Name |
2-hexyl-3-methylensuccinic acid |
Appearance |
Colorless solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H18O4 |
InChI |
InChI=1S/C11H18O4/c1-3-4-5-6-7-9(11(14)15)8(2)10(12)13/h9H,2-7H2,1H3,(H,12,13)(H,14,15) |
InChIKey |
HKMDCNSGDQBQLI-UHFFFAOYSA-N |
Instrument Name |
Finnigan MAT 95 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/np034061x |
Molecular Weight |
214.261 g/mol |
Optical Rotation |
[a]D23 = -17.9 (c = 0.5, MeOH) |
SMILES |
OC(C(C(C(O)=O)=C)CCCCCC)=O |
SPLASH |
splash10-02vi-0900000000-ae5a1bd5210c7c4e30c0 |
Source of Spectrum |
G4-67-1062-4 |
Synonyms |
(-)-Hexylitaconic acid |
Wiley ID |
1884026 |