| SpectraBase Compound ID | B5MPuTuci6v |
|---|---|
| InChI | InChI=1S/C21H30O3Se/c1-18(2,22)15-10-11-19(3)14-24-20(4)17(13-23-21(19,20)12-15)25-16-8-6-5-7-9-16/h5-9,15,17,22H,10-14H2,1-4H3/t15-,17+,19+,20-,21-/m1/s1 |
| InChIKey | USNVEYACLJYZHX-CRSFFPMXSA-N |
| Mol Weight | 409.44 g/mol |
| Molecular Formula | C21H30O3Se |
| Exact Mass | 410.136017 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CqaOqQPflCI |
|---|---|
| Name | (3S,4S,5R)-1,4:2,5-Diepoxy-3-phenylselanyl-1,2-secoeudesman-11-ol |
| Alternate Name(s) | 2-[(3S,3aS,5aS,8R,9aR)-3a,5a-dimethyl-3-(phenylseleno)-3,5,6,7,8,9-hexahydro-2H-furo[2,3-i]isobenzofuran-8-yl]-2-propanol 2-[(3S,3aS,5aS,8R,9aR)-3a,5a-dimethyl-3-phenylselanyl-3,5,6,7,8,9-hexahydro-2H-furo[2,3-i]isobenzofuran-8-yl]propan-2-ol 2-[(3S,3aS,5aS,8R,9aR)-3a,5a-dimethyl-3-phenylselanyl-3,5,6,7,8,9-hexahydro-2H-furo[2,3-i][2]benzofuran-8-yl]propan-2-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30O3Se |
| InChI | InChI=1S/C21H30O3Se/c1-18(2,22)15-10-11-19(3)14-24-20(4)17(13-23-21(19,20)12-15)25-16-8-6-5-7-9-16/h5-9,15,17,22H,10-14H2,1-4H3/t15-,17+,19+,20-,21-/m1/s1 |
| InChIKey | USNVEYACLJYZHX-CRSFFPMXSA-N |
| Molecular Weight | 409.440 g/mol |
| SMILES | OC([C@]1(C[C@@]23[C@](OC[C@@]3(CC1)C)([C@@]([Se]c1ccccc1)(CO2)[H])C)[H])(C)C |
| SPLASH | splash10-001i-0901000000-399307378f33d8cd06e2 |
| Source of Spectrum | F-68-4430-35 |
| Wiley ID | 1572598 |