| SpectraBase Compound ID | 5AZZBrCSnk8 |
|---|---|
| InChI | InChI=1S/C23H30O6/c1-13(2)23(27)9-8-22(4)12-17(25)14(3)10-19(20(22)23)29-21(26)15-6-7-16(24)18(11-15)28-5/h6-7,10-11,13,19-20,24,27H,8-9,12H2,1-5H3/t19-,20+,22+,23+/m0/s1 |
| InChIKey | OZMABICMIHKNMC-KKSHJYNMSA-N |
| Mol Weight | 402.49 g/mol |
| Molecular Formula | C23H30O6 |
| Exact Mass | 402.204239 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GdAUTShNdCA |
|---|---|
| Name | Lancerodiol - vanillate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H30O6 |
| InChI | InChI=1S/C23H30O6/c1-13(2)23(27)9-8-22(4)12-17(25)14(3)10-19(20(22)23)29-21(26)15-6-7-16(24)18(11-15)28-5/h6-7,10-11,13,19-20,24,27H,8-9,12H2,1-5H3/t19-,20+,22+,23+/m0/s1 |
| InChIKey | OZMABICMIHKNMC-KKSHJYNMSA-N |
| Molecular Weight | 402.487 g/mol |
| SMILES | O[C@]1(CC[C@]2([C@]1([C@@](OC(c1ccc(c(c1)OC)O)=O)(C=C(C(C2)=O)C)[H])[H])C)C(C)C |
| SPLASH | splash10-0udi-0900000000-ab183b1d8339329ed1ef |
| Source of Spectrum | X2-50-833-4 |
| Wiley ID | 1602437 |