SpectraBase Spectrum ID |
HG9tY3CKrRH |
Name |
2-(Methoxycarbonyl)-4-methyl-6-(2,6,6-trimethylcyclohex-1-enyl)hex-2-enoic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H28O4 |
InChI |
InChI=1S/C18H28O4/c1-12(11-14(16(19)20)17(21)22-5)8-9-15-13(2)7-6-10-18(15,3)4/h11-12H,6-10H2,1-5H3,(H,19,20) |
InChIKey |
FLWLSXDMJQWHNW-UHFFFAOYSA-N |
Ionization Type |
DIP-EI |
Molecular Weight |
308.418 g/mol |
SMILES |
OC(C(C(OC)=O)=CC(CCC1=C(CCCC1(C)C)C)C)=O |
SPLASH |
splash10-0a4l-0952000000-e5abfaf5496d6966b33d |
Sample Comments |
E/Z = 1:1 |
Source of Spectrum |
WO2012085056A1 |
Wiley ID |
1845450 |