| SpectraBase Compound ID | CO045LLcb7p |
|---|---|
| InChI | InChI=1S/C30H51NO/c1-19(2)10-9-11-20(3)23-13-14-24-22-12-15-26-28(5,6)27(31-32)18-21(4)30(26,8)25(22)16-17-29(23,24)7/h18-20,22-26,32H,9-17H2,1-8H3/b31-27+/t20-,22+,23-,24+,25+,26+,29-,30-/m1/s1/i4D3 |
| InChIKey | FQEZTHAGEHJAJX-NSLZNASUSA-N |
| Mol Weight | 444.8 g/mol |
| Molecular Formula | C30H482D3NO |
| Exact Mass | 444.415896 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2JMXCYV6rg |
|---|---|
| Name | 4,4-Dimethyl-1-trideuteriomethyl-5.alpha.-cholesta-1-en-3-one oxime |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H48D3NO |
| InChI | InChI=1S/C30H51NO/c1-19(2)10-9-11-20(3)23-13-14-24-22-12-15-26-28(5,6)27(31-32)18-21(4)30(26,8)25(22)16-17-29(23,24)7/h18-20,22-26,32H,9-17H2,1-8H3/b31-27+/t20-,22+,23-,24+,25+,26+,29-,30-/m1/s1/i4D3 |
| InChIKey | FQEZTHAGEHJAJX-NSLZNASUSA-N |
| Molecular Weight | 444.762 g/mol |
| SMILES | O\N=C/1C=C([C@]2([C@](C1(C)C)(CC[C@]1([C@@]3(CC[C@@]([C@]3(CC[C@]21[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])[H])C)C([2D])([2D])[2D] |
| SPLASH | splash10-052f-9100300000-258abb1f66f58886b2f9 |
| Source of Spectrum | KC-1992-1853-28 |
| Wiley ID | 776566 |