| SpectraBase Spectrum ID |
F2NhabysMQO |
| Name |
(1S,2S)-3-methyl-2,3-diphenyl-cyclobutanecarbaldehyde |
| Appearance |
Coloeless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18O |
| InChI |
InChI=1S/C18H18O/c1-18(16-10-6-3-7-11-16)12-15(13-19)17(18)14-8-4-2-5-9-14/h2-11,13,15,17H,12H2,1H3/t15-,17-,18?/m1/s1 |
| InChIKey |
MXUAIIFAPLJBLE-KOFGWKMWSA-N |
| Instrument Name |
Thermo Scientific DFS-HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202001634 |
| Molecular Weight |
250.341 g/mol |
| Optical Rotation |
[a]D25 = +92 (c = 1, CH2Cl2) |
| Reported Formula |
C18H18O |
| SMILES |
[C@]1(CC([C@@]1(c1ccccc1)[H])(c1ccccc1)C)(C=O)[H] |
| SPLASH |
splash10-0gb9-0900000000-da0073d1badfd8d570e1 |
| Sample Comments |
dr = 61:39, er = 92:8 (major), er = 94:6 (minor) |
| Source of Spectrum |
ACI-59-SM103-3ae |
| Thin-Layer Chromatography |
Rf = 0.39 (P/EtOAc, 9:1) |
| Wiley ID |
1857963 |
