SpectraBase Spectrum ID |
IgHMG3KMrvK |
Name |
(4R,5R)-4-(2-Methoxyphenyl)-2,2-dimethyl-5-phenyl-1,3-dioxolane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
284.141244501 u |
Formula |
C18H20O3 |
InChI |
InChI=1S/C18H20O3/c1-18(2)20-16(13-9-5-4-6-10-13)17(21-18)14-11-7-8-12-15(14)19-3/h4-12,16-17H,1-3H3/t16-,17-/m1/s1 |
InChIKey |
APVYEYOXOSGOOM-IAGOWNOFSA-N |
SMILES |
[C@@]1([C@](OC(O1)(C)C)(C1=CC=CC=C1)[H])(C=1C(OC)=CC=CC1)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.813521 |