| SpectraBase Compound ID | AGn9My0OfkY |
|---|---|
| InChI | InChI=1S/C12H12O4/c13-11-9(4-5-15-11)7-2-1-3-8-10(7)6-16-12(8)14/h3-4,7,10H,1-2,5-6H2/t7-,10+/m1/s1 |
| InChIKey | APEPCFIVJSRFRT-XCBNKYQSSA-N |
| Mol Weight | 220.22 g/mol |
| Molecular Formula | C12H12O4 |
| Exact Mass | 220.073559 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BbHRwHoqWKF |
|---|---|
| Name | (-)-Diferrolide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O4 |
| InChI | InChI=1S/C12H12O4/c13-11-9(4-5-15-11)7-2-1-3-8-10(7)6-16-12(8)14/h3-4,7,10H,1-2,5-6H2/t7-,10+/m1/s1 |
| InChIKey | APEPCFIVJSRFRT-XCBNKYQSSA-N |
| Molecular Weight | 220.224 g/mol |
| SMILES | C=12[C@]([C@@](C=3C(OCC3)=O)(CCC1)[H])(COC2=O)[H] |
| SPLASH | splash10-03di-1900000000-878c5812b3d529af2573 |
| Source of Spectrum | U-1993-680-1 |
| Synonyms | (3aS,4S)-4-(2',5'-Dihydro-2'-oxo-3'-furanyl)-3a,4,5,6-tetrahydro-1(3H)-benzofuranone (3aS,4S)-4-(2,5-Dihydro-2-oxo-3-furanyl)-3a,4,5,6-tetrahydro-1(3H)-benzofuranone (3aS,4S)-4-(2-oxo-2,5-dihydro-3-furanyl)-3a,4,5,6-tetrahydro-2-benzofuran-1(3H)-one (3aS,4S)-4-(5-oxo-2H-furan-4-yl)-3a,4,5,6-tetrahydro-3H-2-benzofuran-1-one (3aS,4S)-4-(5-oxo-2H-furan-4-yl)-3a,4,5,6-tetrahydro-3H-isobenzofuran-1-one (3aS,4S)-4-(5-oxidanylidene-2H-furan-4-yl)-3a,4,5,6-tetrahydro-3H-2-benzofuran-1-one |
| Wiley ID | 765172 |