| SpectraBase Compound ID | LHjyH6S9zpa |
|---|---|
| InChI | InChI=1S/2C34H57N3S/c2*1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-25-22-27(36-37-32(38)35-26-12-7-6-8-13-26)18-20-33(25,4)31(28)19-21-34(29,30)5/h2*14,23-24,26,28-31H,6-13,15-22H2,1-5H3,(H2,35,37,38)/b2*36-27+/t2*24-,28+,29-,30+,31+,33+,34-/m11/s1 |
| InChIKey | KLDZXKNMSLODIU-XAPAVPTESA-N |
| Mol Weight | 539.9 g/mol |
| Molecular Formula | C34H57N3S |
| Exact Mass | 539.42732 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BuIWFCQIuC0 |
|---|---|
| Name | CHOLEST-5-EN-3-ONE-CYCLOHEXYL-THIOSEMICARBAZONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H57N3S |
| InChI | InChI=1S/2C34H57N3S/c2*1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-25-22-27(36-37-32(38)35-26-12-7-6-8-13-26)18-20-33(25,4)31(28)19-21-34(29,30)5/h2*14,23-24,26,28-31H,6-13,15-22H2,1-5H3,(H2,35,37,38)/b2*36-27+/t2*24-,28+,29-,30+,31+,33+,34-/m11/s1 |
| InChIKey | KLDZXKNMSLODIU-XAPAVPTESA-N |
| Literature Reference Author | A.M.ASIRI,S.A.KHAN |
| Literature Reference Citation | MOLECULES,15,4784(2010) |
| Literature Reference DOI | 10.3390/molecules15074784 |
| Molecular Weight | 539.907 g/mol |
| Sample ID | 71064 |
| Solvent | DMSO-D6 |