| SpectraBase Spectrum ID |
3x6DAgPpgRf |
| Name |
3-(Ethoxycarbonyl)-4,6-dimethyl-5-butyl-2-pyranone |
| Alternate Name(s) |
ethyl 5-butyl-4,6-dimethyl-2-oxo-2H-pyran-3-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O4 |
| InChI |
InChI=1S/C14H20O4/c1-5-7-8-11-9(3)12(13(15)17-6-2)14(16)18-10(11)4/h5-8H2,1-4H3 |
| InChIKey |
OBCCDWJHSJWIAZ-UHFFFAOYSA-N |
| Molecular Weight |
252.310 g/mol |
| SMILES |
C1(C(=C(C(=C(O1)C)CCCC)C)C(=O)OCC)=O |
| SPLASH |
splash10-0f89-0950000000-47139a1958d1bb966dd7 |
| Source of Spectrum |
F-68-9002-6 |
| Wiley ID |
1573687 |
