| SpectraBase Spectrum ID |
3n9GOufInJR |
| Name |
(R*,1'S*,4'R*)-(3-Chloro-4-methoxyphenyl)(1'-methyl-2'-ethylene-4'-pentylcyclobutyl)methanol |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.169957807 u |
| Formula |
C19H27ClO2 |
| InChI |
InChI=1S/C19H27ClO2/c1-5-6-7-8-15-11-13(2)19(15,3)18(21)14-9-10-17(22-4)16(20)12-14/h9-10,12,15,18,21H,2,5-8,11H2,1,3-4H3/t15-,18-,19-/m1/s1 |
| InChIKey |
JYADOHDWCLYYDJ-ATZDWAIDSA-N |
| Instrument Name |
Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201604585 |
| Molecular Weight |
322.876 g/mol |
| Quality |
97 |
| Reported Formula |
C19H27O2Cl |
| SMILES |
O[C@@]([C@]1([C@@](CC1=C)(CCCCC)[H])C)(C1=CC(=C(C=C1)OC)Cl)[H] |
| SPLASH |
splash10-00di-2900000000-b8b0e9cc8ab0759d5beb |
| Sample Comments |
dr = 99:1:0:0 |
| Source of Spectrum |
QE-23-SM21-12j (DOI: 10.1002/chem.201604585) |
| Thin-Layer Chromatography |
0.35 (hexane/EtOAc, 9:1, UV, KMnO4, PAA) |
| Wiley ID |
1903858 |
