SpectraBase Spectrum ID |
23enPCPj44I |
Name |
Cinnamic acid, .alpha.-[N-benzoylamino]-3,5-di-T-butyl-4-hydroxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
409.225308478 u |
Formula |
C25H31NO4 |
InChI |
InChI=1S/C25H31NO4/c1-24(2,3)18-13-16(14-19(21(18)27)25(4,5)6)15-20(23(29)30-7)26-22(28)17-11-9-8-10-12-17/h8-15,27H,1-7H3,(H,26,28)/b20-15- |
InChIKey |
BLOHJFARBIEMEY-HKWRFOASSA-N |
Molecular Weight |
409.526 g/mol |
SMILES |
C1(=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)\C=C\(NC(=O)C1=CC=CC=C1)C(OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879818 |