| SpectraBase Compound ID | 807MCO0vMwK |
|---|---|
| InChI | InChI=1S/C34H54O4/c1-22(35)37-21-30(5)16-17-31(6)18-19-33(8)25-10-11-26-29(3,4)28(38-23(2)36)13-14-32(26,7)24(25)12-15-34(33,9)27(31)20-30/h26-28H,10-21H2,1-9H3/t26-,27+,28+,30+,31+,32+,33+,34-/m0/s1 |
| InChIKey | JUXWPYJBVZPTNJ-HQQKMQDPSA-N |
| Mol Weight | 526.8 g/mol |
| Molecular Formula | C34H54O4 |
| Exact Mass | 526.40221 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LM5WE0zp3JL |
|---|---|
| Name | 3-Epibryonolol diacetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H54O4 |
| InChI | InChI=1S/C34H54O4/c1-22(35)37-21-30(5)16-17-31(6)18-19-33(8)25-10-11-26-29(3,4)28(38-23(2)36)13-14-32(26,7)24(25)12-15-34(33,9)27(31)20-30/h26-28H,10-21H2,1-9H3/t26-,27+,28+,30+,31+,32+,33+,34-/m0/s1 |
| InChIKey | JUXWPYJBVZPTNJ-HQQKMQDPSA-N |
| Molecular Weight | 526.802 g/mol |
| SMILES | [C@@]12(C3=C([C@]4(CC[C@](C([C@@]4(CC3)[H])(C)C)(OC(=O)C)[H])C)CC[C@]2([C@@]2(C[C@@](COC(=O)C)(C)CC[C@@]2(CC1)C)[H])C)C |
| SPLASH | splash10-0udi-0191110000-0094f78536dd5e71a59d |
| Source of Spectrum | E1-40-1201-9 |
| Wiley ID | 1519370 |