SpectraBase Spectrum ID |
LjRXL0WCPlB |
Name |
1,3-Dioxane-5-methanol, 5,5'-[oxybis(methylene)]bis[2-phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
430.199153299 u |
Formula |
C24H30O7 |
InChI |
InChI=1S/C24H30O7/c25-11-23(15-28-21(29-16-23)19-7-3-1-4-8-19)13-27-14-24(12-26)17-30-22(31-18-24)20-9-5-2-6-10-20/h1-10,21-22,25-26H,11-18H2 |
InChIKey |
YBVKMYWBUUDPAG-UHFFFAOYSA-N |
Molecular Weight |
430.497 g/mol |
SMILES |
C(O)C1(COCC2(CO)COC(OC2)C2=CC=CC=C2)COC(OC1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.843234 |