| SpectraBase Spectrum ID |
YHZUaCY5Li |
| Name |
(1S,2S)-2-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-1-(4-fluorophenyl)cyclobutanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.131822632 u |
| Formula |
C15H19FO3 |
| InChI |
InChI=1S/C15H19FO3/c1-14(2)18-9-13(19-14)12-7-8-15(12,17)10-3-5-11(16)6-4-10/h3-6,12-13,17H,7-9H2,1-2H3/t12-,13+,15+/m0/s1 |
| InChIKey |
XLXNBOKUSUPOIR-GZBFAFLISA-N |
| Molecular Weight |
266.312 g/mol |
| SMILES |
[C@]1([C@]([C@@]2(OC(C)(C)OC2)[H])(CC1)[H])(C1=CC=C(C=C1)F)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942793 |
![(1S,2S)-2-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-1-(4-fluorophenyl)cyclobutanol](/api/spectrum/YHZUaCY5Li/structure.png?h=300&w=458 "(1S,2S)-2-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-1-(4-fluorophenyl)cyclobutanol")
