| SpectraBase Spectrum ID |
2fg0ot2vpJi |
| Name |
methyl (4R)-2,4,8-trimethylnona-2,7-dienoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H22O2 |
| InChI |
InChI=1S/C13H22O2/c1-10(2)7-6-8-11(3)9-12(4)13(14)15-5/h7,9,11H,6,8H2,1-5H3/t11-/m1/s1 |
| InChIKey |
QJZDNRNUGNTFNQ-LLVKDONJSA-N |
| Instrument Name |
FINNIGAN MAT 95Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202002297 |
| Molecular Weight |
210.317 g/mol |
| Optical Rotation |
[a]D20 = -4.5 (c = 0.4, CHCl3) |
| Reported Formula |
C13H22O2 |
| SMILES |
C(=CCC[C@](C=C(C(OC)=O)C)(C)[H])(C)C |
| SPLASH |
splash10-0cej-7900000000-24d3ab5ae2c4a455d6f3 |
| Sample Comments |
82% ee |
| Source of Spectrum |
QE-76-SM30-(R)-3k |
| Wiley ID |
1843544 |
