| SpectraBase Compound ID | 8n9mxGlSNwl |
|---|---|
| InChI | InChI=1S/C19H22O6/c1-9-6-14(24-17(9)21)23-8-12-10-7-11-13(20)4-5-19(2,3)15(11)16(10)25-18(12)22/h6,8,10,13-14,16,20H,4-5,7H2,1-3H3/b12-8+/t10-,13+,14?,16+/m1/s1 |
| InChIKey | VOFXXOPWCBSPAA-YPHBXKBKSA-N |
| Mol Weight | 346.38 g/mol |
| Molecular Formula | C19H22O6 |
| Exact Mass | 346.141638 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JDmg1XDjmmc |
|---|---|
| Name | Strigol |
| CAS Registry Number | 11017-56-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H22O6 |
| InChI | InChI=1S/C19H22O6/c1-9-6-14(24-17(9)21)23-8-12-10-7-11-13(20)4-5-19(2,3)15(11)16(10)25-18(12)22/h6,8,10,13-14,16,20H,4-5,7H2,1-3H3/b12-8+/t10-,13+,14?,16+/m1/s1 |
| InChIKey | VOFXXOPWCBSPAA-YPHBXKBKSA-N |
| Molecular Weight | 346.379 g/mol |
| SMILES | O[C@@]1(C=2C[C@]3([C@](C2C(CC1)(C)C)([H])OC(\C3=C/OC1OC(=O)C(=C1)C)=O)[H])[H] |
| SPLASH | splash10-0005-9020000000-3b1570e4282152ceb101 |
| Source of Spectrum | F-47-1415-8 |
| Synonyms | (+)-Strigol (3E,3aR,5S,8bS)-5-hydroxy-8,8-dimethyl-3-[(4-methyl-5-oxo-2H-furan-2-yl)oxymethylidene]-3a,4,5,6,7,8b-hexahydroindeno[1,2-b]furan-2-one (3E,3aR,5S,8bS)-5-hydroxy-8,8-dimethyl-3-[(4-methyl-5-oxo-2H-furan-2-yl)oxymethylene]-3a,4,5,6,7,8b-hexahydroindeno[1,2-b]furan-2-one (3E,3aR,5S,8bS)-8,8-dimethyl-3-[(4-methyl-5-oxidanylidene-2H-furan-2-yl)oxymethylidene]-5-oxidanyl-3a,4,5,6,7,8b-hexahydroindeno[1,2-b]furan-2-one |
| Wiley ID | 1339239 |