SpectraBase Spectrum ID |
I3gXPrHIwWz |
Name |
Bisphenol tmc, bis(2-methylpropionate) |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
450.277009700 u |
Formula |
C29H38O4 |
InChI |
InChI=1S/C29H38O4/c1-19(2)26(30)32-24-12-8-22(9-13-24)29(17-21(5)16-28(6,7)18-29)23-10-14-25(15-11-23)33-27(31)20(3)4/h8-15,19-21H,16-18H2,1-7H3 |
InChIKey |
YIODJQXWDGXFRM-UHFFFAOYSA-N |
Molecular Weight |
450.619 g/mol |
SMILES |
C1=CC(OC(C(C)C)=O)=CC=C1C1(CC(C)(C)CC(C1)C)C1=CC=C(C=C1)OC(C(C)C)=O |