| SpectraBase Compound ID | I157kq3LD1D |
|---|---|
| InChI | InChI=1S/C33H53N/c1-24(2)12-11-13-25(3)28-17-18-29-27-23-34(22-26-14-7-6-8-15-26)31-16-9-10-20-33(31,5)30(27)19-21-32(28,29)4/h6-8,14-15,24-25,27-31H,9-13,16-23H2,1-5H3 |
| InChIKey | GMXHPJQSFIOLLH-UHFFFAOYSA-N |
| Mol Weight | 463.8 g/mol |
| Molecular Formula | C33H53N |
| Exact Mass | 463.417801 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 99cnVOKX58e |
|---|---|
| Name | N-Benzyl-6-aza-5-.xi.cholestane |
| CAS Registry Number | 16373-52-7 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C33H53N |
| InChI | InChI=1S/C33H53N/c1-24(2)12-11-13-25(3)28-17-18-29-27-23-34(22-26-14-7-6-8-15-26)31-16-9-10-20-33(31,5)30(27)19-21-32(28,29)4/h6-8,14-15,24-25,27-31H,9-13,16-23H2,1-5H3 |
| InChIKey | GMXHPJQSFIOLLH-UHFFFAOYSA-N |
| Molecular Weight | 463.794 g/mol |
| SMILES | C1N(C2C(C3CCC4(C(C13)CCC4C(CCCC(C)C)C)C)(CCCC2)C)Cc1ccccc1 |
| SPLASH | splash10-03di-1000900000-9d4d53341c7071ed47ea |
| Source of Spectrum | F-23-4588-3 |
| Synonyms | 6-Azacholestane, 6-benzyl- 5-Benzyl-1-(1,5-dimethylhexyl)-9a,11a-dimethylhexadecahydro-1H-cyclopenta[i]phenanthridine 5-Benzyl-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1,2,3,3a,3b,4,5a,6,7,8,9,9b,10,11-tetradecahydrocyclopenta[i]phenanthridine 5-Benzyl-1-(1,5-dimethylhexyl)-9a,11a-dimethyl-1,2,3,3a,3b,4,5a,6,7,8,9,9b,10,11-tetradecahydrocyclopenta[i]phenanthridine 9a,11a-dimethyl-1-(6-methylheptan-2-yl)-5-(phenylmethyl)-1,2,3,3a,3b,4,5a,6,7,8,9,9b,10,11-tetradecahydrocyclopenta[i]phenanthridine |
| Wiley ID | 1686279 |