| SpectraBase Compound ID | 8f1Fudx4ffI |
|---|---|
| InChI | InChI=1S/C21H34/c1-19(2)11-6-13-21(4)17-10-14-20(3)12-5-7-16(20)15(17)8-9-18(19)21/h16,18H,5-14H2,1-4H3/t16-,18-,20+,21+/m0/s1 |
| InChIKey | NCFQRYCVYQQRGQ-XIGKFDRGSA-N |
| Mol Weight | 286.5 g/mol |
| Molecular Formula | C21H34 |
| Exact Mass | 286.266051 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A013DsClenH |
|---|---|
| Name | Androst-8-ene, 4,4-dimethyl-, (5.alpha.,13.alpha.)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.266051095 u |
| Formula | C21H34 |
| InChI | InChI=1S/C21H34/c1-19(2)11-6-13-21(4)17-10-14-20(3)12-5-7-16(20)15(17)8-9-18(19)21/h16,18H,5-14H2,1-4H3/t16-,18-,20+,21+/m0/s1 |
| InChIKey | NCFQRYCVYQQRGQ-XIGKFDRGSA-N |
| SMILES | C12=C([C@@]3(CCC[C@@]3(CC2)C)[H])CC[C@@]2([C@@]1(CCCC2(C)C)C)[H] |