| SpectraBase Spectrum ID |
KL7aLftZ2N6 |
| Name |
3-(1'-Methylene-2',2'-bis(ethoxycarbonyl)-3'-phenylpropyl)-5-hexen-2-one |
| Alternate Name(s) |
diethyl 2-(2-acetyl-1-methylene-4-pentenyl)-2-benzylmalonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O5 |
| InChI |
InChI=1S/C22H28O5/c1-6-12-19(17(5)23)16(4)22(20(24)26-7-2,21(25)27-8-3)15-18-13-10-9-11-14-18/h6,9-11,13-14,19H,1,4,7-8,12,15H2,2-3,5H3 |
| InChIKey |
UBVRTIXDWJWFDY-UHFFFAOYSA-N |
| Molecular Weight |
372.461 g/mol |
| SMILES |
C(C(C(C(=O)C)CC=C)=C)(C(=O)OCC)(C(=O)OCC)Cc1ccccc1 |
| SPLASH |
splash10-001i-2009000000-e4eb7722d5cdd0bd4b78 |
| Source of Spectrum |
KC-61-4161-5 |
| Wiley ID |
1628869 |
