| SpectraBase Spectrum ID |
I62P2WgRP3H |
| Name |
[(1S,2S)-3-isopropenyl-2-(4-methoxyphenyl)-3-methyl-cyclobutyl]methanol |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O2 |
| InChI |
InChI=1S/C16H22O2/c1-11(2)16(3)9-13(10-17)15(16)12-5-7-14(18-4)8-6-12/h5-8,13,15,17H,1,9-10H2,2-4H3/t13-,15-,16?/m1/s1 |
| InChIKey |
VRKAHMXPZWFMDX-CWSLVUQWSA-N |
| Instrument Name |
Thermo Scientific DFS-HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202001634 |
| Molecular Weight |
246.350 g/mol |
| Optical Rotation |
[a]D25 = +50 (c = 1, CH2Cl2) |
| Reported Formula |
C16H22O2 |
| SMILES |
OC[C@]1(CC([C@@]1(c1ccc(cc1)OC)[H])(C(C)=C)C)[H] |
| SPLASH |
splash10-001i-9100000000-41496a30d93d962d9005 |
| Sample Comments |
dr = 84:16, er = 95:5 |
| Source of Spectrum |
ACI-59-SM79-S14ja |
| Thin-Layer Chromatography |
Rf = 0.26 (P/Et2O, 1:1) |
| Wiley ID |
1857980 |
![[(1S,2S)-3-isopropenyl-2-(4-methoxyphenyl)-3-methyl-cyclobutyl]methanol](/api/spectrum/I62P2WgRP3H/structure.png?h=300&w=458 "[(1S,2S)-3-isopropenyl-2-(4-methoxyphenyl)-3-methyl-cyclobutyl]methanol")
