| SpectraBase Compound ID | 44i9PkjE25e |
|---|---|
| InChI | InChI=1S/C22H28O6/c1-11-6-16-20(26,18(11)25)9-14(10-23)7-15-17-19(4,5)21(17,28-13(3)24)8-12(2)22(15,16)27/h6-7,10,12,15-17,26-27H,8-9H2,1-5H3/t12-,15+,16-,17-,20-,21+,22-/m1/s1 |
| InChIKey | RBAKUBXTGCEYKA-HXGSDTCMSA-N |
| Mol Weight | 388.46 g/mol |
| Molecular Formula | C22H28O6 |
| Exact Mass | 388.188589 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6UQdJLjTwGL |
|---|---|
| Name | 12-Deoxy-phorbaldehyde-13-acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H28O6 |
| InChI | InChI=1S/C22H28O6/c1-11-6-16-20(26,18(11)25)9-14(10-23)7-15-17-19(4,5)21(17,28-13(3)24)8-12(2)22(15,16)27/h6-7,10,12,15-17,26-27H,8-9H2,1-5H3/t12-,15+,16-,17-,20-,21+,22-/m1/s1 |
| InChIKey | RBAKUBXTGCEYKA-HXGSDTCMSA-N |
| Molecular Weight | 388.460 g/mol |
| SMILES | O[C@]12[C@]([C@@]3([C@@](C=C(C2)C=O)([C@]2([C@](C2(C)C)(C[C@]3(C)[H])OC(=O)C)[H])[H])O)(C=C(C1=O)C)[H] |
| SPLASH | splash10-03di-0009000000-caf3b49fe00128d1c1fa |
| Source of Spectrum | G4-69-969-5 |
| Wiley ID | 1694363 |