SpectraBase Spectrum ID |
1OLOiyMb0gD |
Name |
2-[4-[tris[4-(carboxymethyl)phenyl]methyl]phenyl]acetic acid |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C33H28O8 |
InChI |
InChI=1S/C33H28O8/c34-29(35)17-21-1-9-25(10-2-21)33(26-11-3-22(4-12-26)18-30(36)37,27-13-5-23(6-14-27)19-31(38)39)28-15-7-24(8-16-28)20-32(40)41/h1-16H,17-20H2,(H,34,35)(H,36,37)(H,38,39)(H,40,41) |
InChIKey |
YCWBZTNKWPEEDO-UHFFFAOYSA-N |
Molecular Weight |
552.579 g/mol |
SMILES |
OC(Cc1ccc(C(c2ccc(CC(=O)O)cc2)(c2ccc(CC(=O)O)cc2)c2ccc(CC(=O)O)cc2)cc1)=O |
SPLASH |
splash10-014i-0000910000-e475421dbb098a4f6667 |
Source of Spectrum |
C5-2002-1160-7 |
Wiley ID |
1614694 |