| SpectraBase Spectrum ID |
34wyu0Ei1t8 |
| Name |
(1S,2R)-2-(2-hydroxyethyl)cyclohexyl 2,4,6-trimethylbenzoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.188194694 u |
| Formula |
C18H26O3 |
| InChI |
InChI=1S/C18H26O3/c1-12-10-13(2)17(14(3)11-12)18(20)21-16-7-5-4-6-15(16)8-9-19/h10-11,15-16,19H,4-9H2,1-3H3/t15-,16+/m1/s1 |
| InChIKey |
NBFRZXKGLJZEDB-CVEARBPZSA-N |
| Instrument Name |
Agilent 7890A-5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201801434 |
| Molecular Weight |
290.403 g/mol |
| Optical Rotation |
[a]D20 = +44.8 (c = 1.1, CH2Cl2) |
| Quality |
214 |
| Reported Formula |
C18H26O3 |
| SMILES |
OCC[C@]1(CCCC[C@@]1(OC(C1=C(C=C(C=C1C)C)C)=O)[H])[H] |
| SPLASH |
splash10-002b-8900000000-03ad04f8aeb26933b24b |
| Source of Spectrum |
QE-24-SM21-5j (DOI: 10.1002/chem.201801434) |
| Wiley ID |
1900265 |
