| SpectraBase Spectrum ID |
1qjF5W36gre |
| Name |
Allyl 4-(3-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
367.178358285 u |
| Formula |
C22H25NO4 |
| InChI |
InChI=1S/C22H25NO4/c1-5-9-27-21(26)18-13(2)23-16-11-22(3,4)12-17(25)20(16)19(18)14-7-6-8-15(24)10-14/h5-8,10,19,23-24H,1,9,11-12H2,2-4H3 |
| InChIKey |
TWJJATUTUQUXEW-UHFFFAOYSA-N |
| Molecular Weight |
367.445 g/mol |
| SMILES |
N1C(=C(C(C2=CC(=CC=C2)O)C=2C(CC(CC12)(C)C)=O)C(=O)OCC=C)C |
