![(2R*,3S*4S*)-2-butyl-4-methyl-3-[(3-methylbutyryl)oxy]-4-butanolide](/api/spectrum/2dgxVMeF7I/structure.png?h=300&w=458 "(2R*,3S*4S*)-2-butyl-4-methyl-3-[(3-methylbutyryl)oxy]-4-butanolide")
| SpectraBase Compound ID | 9zlW01jplvy |
|---|---|
| InChI | InChI=1S/C14H24O4/c1-5-6-7-11-13(10(4)17-14(11)16)18-12(15)8-9(2)3/h9-11,13H,5-8H2,1-4H3/t10-,11+,13+/m0/s1 |
| InChIKey | PCOOFQWEKVUBNN-DMDPSCGWSA-N |
| Mol Weight | 256.34 g/mol |
| Molecular Formula | C14H24O4 |
| Exact Mass | 256.167459 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2dgxVMeF7I |
|---|---|
| Name | (2R*,3S*4S*)-2-butyl-4-methyl-3-[(3-methylbutyryl)oxy]-4-butanolide |
| Alternate Name(s) | 3-Methylbutanoic acid[(2S,3S,4R)-4-butyl-2-methyl-5-oxo-3-oxolanyl]ester 3-Methylbutyric acid[(2S,3S,4R)-4-butyl-5-keto-2-methyl-tetrahydrofuran-3-yl]ester [(2S,3S,4R)-4-butyl-2-methyl-5-oxidanylidene-oxolan-3-yl]3-methylbutanoate [(2S,3S,4R)-4-butyl-2-methyl-5-oxo-tetrahydrofuran-3-yl]3-methylbutanoate [(2S,3S,4R)-4-butyl-2-methyl-5-oxooxolan-3-yl]3-methylbutanoate 3-Methylbutanoic acid [(2S,3S,4R)-4-butyl-2-methyl-5-oxo-3-oxolanyl] ester [(2S,3S,4R)-4-butyl-2-methyl-5-oxooxolan-3-yl] 3-methylbutanoate [(2S,3S,4R)-4-butyl-2-methyl-5-oxo-tetrahydrofuran-3-yl] 3-methylbutanoate [(2S,3S,4R)-4-butyl-2-methyl-5-oxidanylidene-oxolan-3-yl] 3-methylbutanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H24O4 |
| InChI | InChI=1S/C14H24O4/c1-5-6-7-11-13(10(4)17-14(11)16)18-12(15)8-9(2)3/h9-11,13H,5-8H2,1-4H3/t10-,11+,13+/m0/s1 |
| InChIKey | PCOOFQWEKVUBNN-DMDPSCGWSA-N |
| Molecular Weight | 256.342 g/mol |
| SMILES | C1([C@@]([C@](OC(=O)CC(C)C)([C@@](O1)(C)[H])[H])(CCCC)[H])=O |
| SPLASH | splash10-052s-9110000000-e3c841e01e6b6bc02d82 |
| Source of Spectrum | J-58-2951-5 |
| Wiley ID | 1259746 |