| SpectraBase Spectrum ID |
Gkvsh38bPRw |
| Name |
(1S,2S)-3-isopropenyl-2-(4-methoxyphenyl)-3-methyl-cyclobutanecarbaldehyde |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20O2 |
| InChI |
InChI=1S/C16H20O2/c1-11(2)16(3)9-13(10-17)15(16)12-5-7-14(18-4)8-6-12/h5-8,10,13,15H,1,9H2,2-4H3/t13-,15-,16?/m1/s1 |
| InChIKey |
YUGLHPJUUDNISA-CWSLVUQWSA-N |
| Instrument Name |
Thermo Scientific DFS-HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202001634 |
| Molecular Weight |
244.334 g/mol |
| Optical Rotation |
[a]D25 = +108 (c = 1, CH2Cl2) |
| Reported Formula |
C16H20O2 |
| SMILES |
[C@]1(CC([C@@]1(c1ccc(cc1)OC)[H])(C(C)=C)C)(C=O)[H] |
| SPLASH |
splash10-0ue9-1910000000-ca24a56cf1f2495e9162 |
| Sample Comments |
dr = 87:13, er = 95:5 |
| Source of Spectrum |
ACI-59-SM77-3ja |
| Thin-Layer Chromatography |
Rf = 0.25 (P/EtOAc, 9:1) |
| Wiley ID |
1857971 |
