| SpectraBase Spectrum ID |
4gzOK21j88A |
| Name |
Phaseolinic acid - methyl ester |
| Alternate Name(s) |
(2S,3S,4S)-4-methyl-5-oxo-2-pentyl-3-oxolanecarboxylic acid methyl ester
Methyl (2S,3S,4S)-4-methyl-5-oxo-2-pentyloxolane-3-carboxylate
Methyl (2S,3S,4S)-4-methyl-5-oxo-2-pentyl-tetrahydrofuran-3-carboxylate
Methyl (2S,3S,4S)-4-methyl-5-oxidanylidene-2-pentyl-oxolane-3-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H20O4 |
| InChI |
InChI=1S/C12H20O4/c1-4-5-6-7-9-10(12(14)15-3)8(2)11(13)16-9/h8-10H,4-7H2,1-3H3/t8-,9-,10-/m0/s1 |
| InChIKey |
OQEBZUJHYWKFGD-GUBZILKMSA-N |
| Molecular Weight |
228.288 g/mol |
| SMILES |
[C@@]1([C@@](OC([C@]1(C)[H])=O)(CCCCC)[H])(C(=O)OC)[H] |
| SPLASH |
splash10-0690-9400000000-4f06df527c3e83a3cc09 |
| Source of Spectrum |
H-85-3811-13 |
| Wiley ID |
1525074 |
