| SpectraBase Spectrum ID |
GhwoTKXZ57K |
| Name |
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-phenoxyphenyl)-, di(2-propenyl) ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
445.188922968 u |
| Formula |
C27H27NO5 |
| InChI |
InChI=1S/C27H27NO5/c1-5-15-31-26(29)23-18(3)28-19(4)24(27(30)32-16-6-2)25(23)20-11-10-14-22(17-20)33-21-12-8-7-9-13-21/h5-14,17,25,28H,1-2,15-16H2,3-4H3 |
| InChIKey |
KQHXNOPSPSWLIW-UHFFFAOYSA-N |
| Molecular Weight |
445.515 g/mol |
| SMILES |
N1C(=C(C(C(=C1C)C(=O)OCC=C)C=1C=C(OC2=CC=CC=C2)C=CC1)C(=O)OCC=C)C |
