| SpectraBase Compound ID | 3Uwoy1FvO8A |
|---|---|
| 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/h20,23-25H,9-19H2,1-8H3/t23?,24?,25?,27-,28-,29+,30+/m0/s1/i1D,20D/t20?,23?,24?,25?,27-,28-,29+,30+ |
| InChIKey | BJFPMDGPOFJGIR-GSFOORJCSA-N |
| Mol Weight | 412.7 g/mol |
| Molecular Formula | C30H482D2 |
| Exact Mass | 412.403805 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5Ili6Eab9dD |
|---|---|
| Name | Hop-17(21)-ene-23,23-D2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H48D2 |
| 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/h20,23-25H,9-19H2,1-8H3/t23?,24?,25?,27-,28-,29+,30+/m0/s1/i1D,20D/t20?,23?,24?,25?,27-,28-,29+,30+ |
| InChIKey | BJFPMDGPOFJGIR-GSFOORJCSA-N |
| Molecular Weight | 412.742 g/mol |
| SMILES | [C@@]12([C@]3(C([C@]4(CCC(=C4CC3)C(C[2D])(C)[2D])C)CCC1[C@]1(CCCC(C1CC2)(C)C)C)C)C |
| SPLASH | splash10-000i-0923100000-df8687a5a931996d611e |
| Source of Spectrum | E1-40-1684-0 |
| Wiley ID | 1519441 |