| SpectraBase Spectrum ID |
CxRS3yND351 |
| Name |
3-Benzyl-4-methylene-5,5-bis(ethoxycarbonyl)-7-octen-2-one |
| Alternate Name(s) |
diethyl 2-allyl-2-[1-(1-benzyl-2-oxopropyl)vinyl]malonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O5 |
| InChI |
InChI=1S/C22H28O5/c1-6-14-22(20(24)26-7-2,21(25)27-8-3)16(4)19(17(5)23)15-18-12-10-9-11-13-18/h6,9-13,19H,1,4,7-8,14-15H2,2-3,5H3 |
| InChIKey |
OBROYVVQYMSHBF-UHFFFAOYSA-N |
| Molecular Weight |
372.461 g/mol |
| SMILES |
CC(C(C(C(CC=C)(C(=O)OCC)C(=O)OCC)=C)Cc1ccccc1)=O |
| SPLASH |
splash10-0006-9000000000-e4e256924742c8cee3ec |
| Source of Spectrum |
KC-61-4160-5 |
| Wiley ID |
1628871 |
