SpectraBase Spectrum ID |
JeoleK4rykl |
Name |
5-[(E)-3-keto-3-methoxy-prop-1-enoxy]-6-methyl-enanthic acid |
Comments |
Edited after expert review for CH2Cl2 contamination - Original record with SpectrumID 867488 moved to the Legacy library |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H20O5 |
InChI |
InChI=1S/C12H20O5/c1-9(2)10(5-4-6-11(13)14)17-8-7-12(15)16-3/h7-10H,4-6H2,1-3H3,(H,13,14)/b8-7+ |
InChIKey |
WBMMDFDQQDUEGM-BQYQJAHWSA-N |
Molecular Weight |
244.287 g/mol |
SMILES |
OC(CCCC(O\C=C\C(=O)OC)C(C)C)=O |
SPLASH |
splash10-0560-9300000000-d396039854609e46b6ae |
Source of Spectrum |
SK-26-4691-2 |
Synonyms |
5-[(E)-3-methoxy-3-oxidanylidene-prop-1-enoxy]-6-methyl-heptanoic acid
5-[(E)-3-methoxy-3-oxo-prop-1-enoxy]-6-methyl-heptanoic acid |
Wiley ID |
1821057 |