| SpectraBase Spectrum ID |
JgqGZEZnXKR |
| Name |
2,4-Dioxo-3-pentyl 4-[[4-(N-decyloxy)benzoyl]oxy]cinnate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
522.261753557 u |
| Formula |
C31H38O7 |
| InChI |
InChI=1S/C31H38O7/c1-4-5-6-7-8-9-10-11-22-36-27-19-15-26(16-20-27)31(35)37-28-17-12-25(13-18-28)14-21-29(34)38-30(23(2)32)24(3)33/h12-21,30H,4-11,22H2,1-3H3/b21-14+ |
| InChIKey |
WBPANTZOZLCXIR-KGENOOAVSA-N |
| Molecular Weight |
522.638 g/mol |
| SMILES |
C(OC1=CC=C(\C=C\C(OC(C(=O)C)C(=O)C)=O)C=C1)(C1=CC=C(C=C1)OCCCCCCCCCC)=O |
![2,4-Dioxo-3-pentyl 4-[[4-(n-decyloxy)benzoyl]oxy]cinnate](/api/spectrum/JgqGZEZnXKR/structure.png?h=300&w=458 "2,4-Dioxo-3-pentyl 4-[[4-(n-decyloxy)benzoyl]oxy]cinnate")
