| SpectraBase Spectrum ID |
GTK3ND5tLIN |
| Name |
Ethyl 2-{[2-(benzyloxy)-4-methylphenyl]carbonyl}-5-methyl-2-(3-methylbut-2-en-1-yl)hex-4-enoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
448.261359635 u |
| Formula |
C29H36O4 |
| InChI |
InChI=1S/C29H36O4/c1-7-32-28(31)29(17-15-21(2)3,18-16-22(4)5)27(30)25-14-13-23(6)19-26(25)33-20-24-11-9-8-10-12-24/h8-16,19H,7,17-18,20H2,1-6H3 |
| InChIKey |
MSGXGUJXRWNKIW-UHFFFAOYSA-N |
| Molecular Weight |
448.603 g/mol |
| SMILES |
C(C(OCC)=O)(CC=C(C)C)(C(C1=CC=C(C=C1OCC1=CC=CC=C1)C)=O)CC=C(C)C |
![Ethyl 2-{[2-(benzyloxy)-4-methylphenyl]carbonyl}-5-methyl-2-(3-methylbut-2-en-1-yl)hex-4-enoate](/api/spectrum/GTK3ND5tLIN/structure.png?h=300&w=458 "Ethyl 2-{[2-(benzyloxy)-4-methylphenyl]carbonyl}-5-methyl-2-(3-methylbut-2-en-1-yl)hex-4-enoate")
