| SpectraBase Spectrum ID |
Cy2m6QQQaWI |
| Name |
(E)-4-(1',1'-Bis(ethoxycarbonyl)ethyl)-4-nonen-2-one |
| Alternate Name(s) |
diethyl 2-methyl-2-[(1E)-1-(2-oxopropyl)-1-hexenyl]malonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H28O5 |
| InChI |
InChI=1S/C17H28O5/c1-6-9-10-11-14(12-13(4)18)17(5,15(19)21-7-2)16(20)22-8-3/h11H,6-10,12H2,1-5H3/b14-11+ |
| InChIKey |
DIWPHSFFYHDTRW-SDNWHVSQSA-N |
| Molecular Weight |
312.406 g/mol |
| SMILES |
C(\C(CC(=O)C)=C\CCCC)(C(=O)OCC)(C(=O)OCC)C |
| SPLASH |
splash10-0006-9000000000-f22842cb1e1f63e19fd2 |
| Source of Spectrum |
KC-61-4161-5 |
| Wiley ID |
1628863 |
