| SpectraBase Compound ID | 3uFvMUICfBc |
|---|---|
| InChI | InChI=1S/C29H51NO/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)30-26(31)16-18-29(25,7)24(21)15-17-28(22,23)6/h19-25H,8-18H2,1-7H3,(H,30,31)/t20?,21?,22?,23?,24?,25?,28-,29-/m0/s1 |
| InChIKey | LALGAPFGXNZGIE-HUCPIDSOSA-N |
| Mol Weight | 429.7 g/mol |
| Molecular Formula | C29H51NO |
| Exact Mass | 429.397065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FSIPO4Je7xT |
|---|---|
| Name | 4-Aza-A-homo-5.alpha.-cholestan-3-one, 4a,4a-dimethyl- |
| CAS Registry Number | 23498-54-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H51NO |
| InChI | InChI=1S/C29H51NO/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)30-26(31)16-18-29(25,7)24(21)15-17-28(22,23)6/h19-25H,8-18H2,1-7H3,(H,30,31)/t20?,21?,22?,23?,24?,25?,28-,29-/m0/s1 |
| InChIKey | LALGAPFGXNZGIE-HUCPIDSOSA-N |
| Molecular Weight | 429.733 g/mol |
| SMILES | N1C(CC[C@@]2(C(C1(C)C)CCC1C2CC[C@]2(C(CCC12)C(CCCC(C)C)C)C)C)=O |
| SPLASH | splash10-0a4i-9000000000-8be1fa7086d6eaa98bc5 |
| Source of Spectrum | KC-1979-2924-0 |
| Synonyms | 4-Aza-A-homocholestan-3-one, 4a,4a-dimethyl- Cyclopenta[5,6]naphth[2,1-c]azepine, 4-aza-A-homocholestan-3-one deriv. (5aS,7aS)-8-(1,5-dimethylhexyl)-1,1,5a,7a-tetramethylhexadecahydrocyclopenta[5,6]naphtho[2,1-c]azepin-3(2H)-one 4a,4a-dimethyl-4-aza-a-homo-5.alpha.-cholestan-3-one Cyclopenta[5,6]naphth[2,1-c]azepin-3(2H)-one, 8.beta.-(1,5-dimethylhexyl)-1,4,5,5a,5b.alpha.,6,7,7a,8,9,10,10a.alpha.,10b.beta.,11,12,12a.alpha.-hexadecahydro-1,1,5a.beta.,7a.beta.-tetramethyl- |
| Wiley ID | 1381280 |