| SpectraBase Compound ID | L8GmAsoSOTQ |
|---|---|
| InChI | InChI=1S/C21H26O9/c1-8(2)19(24)30-17-14-9(3)20(25)29-16(14)10(4)15-12(28-15)7-13(23)21(6,26)18(17)27-11(5)22/h10,12,14-18,26H,1,3,7H2,2,4-6H3/t10?,12-,14+,15+,16-,17+,18-,21+/m1/s1 |
| InChIKey | CHYXIRYMRBDMII-VEMLVCDGSA-N |
| Mol Weight | 422.43 g/mol |
| Molecular Formula | C21H26O9 |
| Exact Mass | 422.157682 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1IL5bJeWYZ7 |
|---|---|
| Name | 2,3-Epoxy-caleina D |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H26O9 |
| InChI | InChI=1S/C21H26O9/c1-8(2)19(24)30-17-14-9(3)20(25)29-16(14)10(4)15-12(28-15)7-13(23)21(6,26)18(17)27-11(5)22/h10,12,14-18,26H,1,3,7H2,2,4-6H3/t10?,12-,14+,15+,16-,17+,18-,21+/m1/s1 |
| InChIKey | CHYXIRYMRBDMII-VEMLVCDGSA-N |
| Molecular Weight | 422.430 g/mol |
| SMILES | O[C@@]1([C@](OC(=O)C)([C@]([C@@]2([C@@](C([C@@]3(O[C@@]3(CC1=O)[H])[H])C)(OC(=O)C2=C)[H])[H])(OC(C(=C)C)=O)[H])[H])C |
| SPLASH | splash10-00di-0093100000-df7c754b1454704aee0c |
| Source of Spectrum | Y4-77-91-0 |
| Synonyms | 10-Hydroxy-2,3-epoxy8-acetoxy-9-[(isopropyl)carbonyloxy]-1,12-dioxo-4,10-dimethyl-11-methylene-13-oxabicyclo[11.3.0]tridecane |
| Wiley ID | 1512920 |