| SpectraBase Spectrum ID |
A9NlPYCQuZ0 |
| Name |
(1S)-2,2-Dimethyl-1-phenyl-1-[(2R,3S)-3-phenyl-2-oxiranyl]-1-propanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
282.161979946 u |
| Formula |
C19H22O2 |
| InChI |
InChI=1S/C19H22O2/c1-18(2,3)19(20,15-12-8-5-9-13-15)17-16(21-17)14-10-6-4-7-11-14/h4-13,16-17,20H,1-3H3/t16-,17+,19-/m0/s1 |
| InChIKey |
YTPJTDXPWJVUQV-SCTDSRPQSA-N |
| SMILES |
[C@@]1(O[C@]1(C1=CC=CC=C1)[H])([C@](C(C)(C)C)(C=1C=CC=CC1)O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828971 |
![(1S)-2,2-dimethyl-1-phenyl-1-[(2R,3S)-3-phenyl-2-oxiranyl]-1-propanol](/api/spectrum/A9NlPYCQuZ0/structure.png?h=300&w=458 "(1S)-2,2-dimethyl-1-phenyl-1-[(2R,3S)-3-phenyl-2-oxiranyl]-1-propanol")
