SpectraBase Spectrum ID |
DP2Bo0d990d |
Name |
(2R,6E)-2-Methyloctenoic Acid |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
156.115029753 u |
Formula |
C9H16O2 |
InChI |
InChI=1S/C9H16O2/c1-3-4-5-6-7-8(2)9(10)11/h3-4,8H,5-7H2,1-2H3,(H,10,11)/b4-3+/t8-/m1/s1 |
InChIKey |
FKBBGBFWNLFJEZ-MPJRPATESA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/jo3026737 |
Molecular Weight |
156.225 g/mol |
Optical Rotation |
[a]D28 = -17 (c = 1.0, CH2Cl2) |
Quality |
349 |
SMILES |
OC(=O)[C@@](CCC\C=C\C)(C)[H] |
SPLASH |
splash10-0aw9-9100000000-3fc942cca38a84931744 |
Source of Spectrum |
JOC-78-2459-16a (DOI: 10.1021/jo3026737) |
Thin-Layer Chromatography |
0.42 (cyclohexane/ethyl acetate/acetic acid, 100:33:1) |
Wiley ID |
1912371 |