| SpectraBase Spectrum ID |
AqS4myC3MAL |
| Name |
ethyl 2,3,7-trimethylocta-2,6-dienoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H22O2 |
| InChI |
InChI=1S/C13H22O2/c1-6-15-13(14)12(5)11(4)9-7-8-10(2)3/h8H,6-7,9H2,1-5H3 |
| InChIKey |
MDHZSKWEFABKKL-UHFFFAOYSA-N |
| Instrument Name |
MSD5975C |
| Ionization Type |
EI |
| Molecular Weight |
210.317 g/mol |
| SMILES |
C(C)OC(C(=C(CCC=C(C)C)C)C)=O |
| SPLASH |
splash10-014l-9100000000-5f3cfe9f892843c5d46d |
| Sample Comments |
Major isomer, Mixture of E/Z (1.2:1) |
| Source of Spectrum |
WO2017097884A1 |
| Wiley ID |
1855413 |
