| SpectraBase Spectrum ID |
KI0nGAv49AQ |
| Name |
3-Benzyl-4-(1',1'-bis(ethoxycarbonyl)-2'-phenylethyl)-4-penten-2-one |
| Alternate Name(s) |
diethyl 2-benzyl-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 |
C26H30O5 |
| InChI |
InChI=1S/C26H30O5/c1-5-30-24(28)26(25(29)31-6-2,18-22-15-11-8-12-16-22)19(3)23(20(4)27)17-21-13-9-7-10-14-21/h7-16,23H,3,5-6,17-18H2,1-2,4H3 |
| InChIKey |
DHIJJABZRGTXNW-UHFFFAOYSA-N |
| Molecular Weight |
422.521 g/mol |
| SMILES |
C(C(C(C(=O)C)Cc1ccccc1)=C)(C(=O)OCC)(C(=O)OCC)Cc1ccccc1 |
| SPLASH |
splash10-0006-9004000000-e7ebaa0b70806ffaa950 |
| Source of Spectrum |
KC-61-4160-5 |
| Wiley ID |
1628870 |
