| SpectraBase Compound ID | 7nvqkELW5yA |
|---|---|
| InChI | InChI=1S/C28H47NO/c1-18(2)8-7-9-19(3)24-12-13-25-23-11-10-21-17-22(29-30)16-20(4)28(21,6)26(23)14-15-27(24,25)5/h18-19,21,23-26,30H,4,7-17H2,1-3,5-6H3/b29-22+/t19-,21+,23+,24-,25+,26+,27-,28+/m1/s1/i16D/t16-,19-,21+,23+,24-,25+,26+,27-,28+ |
| InChIKey | PZIPLGQPLRDVNQ-HMOCNSOZSA-N |
| Mol Weight | 414.7 g/mol |
| Molecular Formula | C28H462DNO |
| Exact Mass | 414.372042 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9OTUh37NFgz |
|---|---|
| Name | (E)-and (Z)-2.alpha.-Deuterio-1-methylene-5.alpha.-cholestan-3-one oxime |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H46DNO |
| InChI | InChI=1S/C28H47NO/c1-18(2)8-7-9-19(3)24-12-13-25-23-11-10-21-17-22(29-30)16-20(4)28(21,6)26(23)14-15-27(24,25)5/h18-19,21,23-26,30H,4,7-17H2,1-3,5-6H3/b29-22+/t19-,21+,23+,24-,25+,26+,27-,28+/m1/s1/i16D/t16-,19-,21+,23+,24-,25+,26+,27-,28+ |
| InChIKey | PZIPLGQPLRDVNQ-HMOCNSOZSA-N |
| Molecular Weight | 414.696 g/mol |
| SMILES | O\N=C\1C[C@]2([C@@]([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC2)[H])(C([C@]1([2D])[H])=C)C)[H] |
| SPLASH | splash10-0ika-0907800000-d0980eceb64cf4ef8813 |
| Source of Spectrum | KC-1992-1853-34 |
| Wiley ID | 776562 |