| SpectraBase Spectrum ID |
GPfOIFNwDzf |
| Name |
anti-2-methyl-3-(2-methylprop-1-enyl)octanoic acid |
| Appearance |
Liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
212.177630011 u |
| Formula |
C13H24O2 |
| InChI |
InChI=1S/C13H24O2/c1-5-6-7-8-12(9-10(2)3)11(4)13(14)15/h9,11-12H,5-8H2,1-4H3,(H,14,15)/t11-,12+/m0/s1 |
| InChIKey |
VJFXHYYBPZFJDF-NWDGAFQWSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201504870 |
| Molecular Weight |
212.333 g/mol |
| Quality |
131 |
| Reported Formula |
C13H24O2 |
| SMILES |
OC([C@]([C@@](C=C(C)C)(CCCCC)[H])(C)[H])=O |
| SPLASH |
splash10-014i-9100000000-d21be6bd742708f7312b |
| Sample Comments |
dr = 7:1 |
| Source of Spectrum |
QE-22-SM25-anti-3i (DOI: 10.1002/chem.201504870) |
| Wiley ID |
1903028 |
