| SpectraBase Compound ID | J0XGgKqtCrC |
|---|---|
| InChI | InChI=1S/C30H50/c1-20(2)21-12-17-27(5)22(21)13-18-29(7)24(27)10-11-25-28(6)16-9-15-26(3,4)23(28)14-19-30(25,29)8/h21-25H,1,9-19H2,2-8H3/t21-,22+,23+,24-,25-,27+,28+,29-,30-/m1/s1/i2D3,3D3/t21-,22+,23+,24-,25-,26+,27+,28+,29-,30- |
| InChIKey | HHXYJYBYNZMZKX-IIYADJKQSA-N |
| Mol Weight | 416.8 g/mol |
| Molecular Formula | C30H442D6 |
| Exact Mass | 416.428912 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C90XBEU9VbU |
|---|---|
| Name | 23,23,23,30,30,30-Hexadeuterio-hop-22(29)-ene |
| Alternate Name(s) | Methylidenesqualene hexadeuterio-derivative |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H44D6 |
| InChI | InChI=1S/C30H50/c1-20(2)21-12-17-27(5)22(21)13-18-29(7)24(27)10-11-25-28(6)16-9-15-26(3,4)23(28)14-19-30(25,29)8/h21-25H,1,9-19H2,2-8H3/t21-,22+,23+,24-,25-,27+,28+,29-,30-/m1/s1/i2D3,3D3/t21-,22+,23+,24-,25-,26+,27+,28+,29-,30- |
| InChIKey | HHXYJYBYNZMZKX-IIYADJKQSA-N |
| Molecular Weight | 416.767 g/mol |
| SMILES | [C@@]12([C@]3([C@]([C@]4(CC[C@@]([C@@]4(CC3)[H])(C(=C)C([2D])([2D])[2D])[H])C)([H])CC[C@@]1([C@]1(CCC[C@]([C@@]1(CC2)[H])(C([2D])([2D])[2D])C)C)[H])C)C |
| SPLASH | splash10-0007-6910000000-82a5d0089babfd9c870a |
| Source of Spectrum | OL-6-805-0 |
| Wiley ID | 1577700 |