| SpectraBase Compound ID | 6xu3aRitWjL |
|---|---|
| InChI | InChI=1S/C29H48N2O3/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-21-16-26(30-20(4)32)27(31(33)34)17-29(21,6)25(22)14-15-28(23,24)5/h18-19,21-25H,7-17H2,1-6H3,(H,30,32)/t19-,21?,22+,23-,24+,25+,28-,29+/m1/s1 |
| InChIKey | HNTQDIVCQPHXFG-VIWGLCJKSA-N |
| Mol Weight | 472.7 g/mol |
| Molecular Formula | C29H48N2O3 |
| Exact Mass | 472.366493 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JcPT28YhSNe |
|---|---|
| Name | 3-Acetamido-2-nitrocholest-2-ene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H48N2O3 |
| InChI | InChI=1S/C29H48N2O3/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-21-16-26(30-20(4)32)27(31(33)34)17-29(21,6)25(22)14-15-28(23,24)5/h18-19,21-25H,7-17H2,1-6H3,(H,30,32)/t19-,21?,22+,23-,24+,25+,28-,29+/m1/s1 |
| InChIKey | HNTQDIVCQPHXFG-VIWGLCJKSA-N |
| Molecular Weight | 472.714 g/mol |
| SMILES | N(C1=C(N(=O)=O)C[C@@]2([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CCC2C1)[H])C)C(=O)C |
| SPLASH | splash10-0ugi-0002900000-217e06ea028bf9238caa |
| Source of Spectrum | F-53-16165-3 |
| Synonyms | N-(2-nitrocholest-2-en-3-yl)acetamide |
| Wiley ID | 804409 |