| SpectraBase Compound ID | IBN4Pv3bnoj |
|---|---|
| InChI | InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15+/m0/s1/i1D,6D,7D,13D/t1?,6?,7?,11-,12+,13+,15+ |
| InChIKey | ZSBXGIUJOOQZMP-DOGBUHTCSA-N |
| Mol Weight | 252.39 g/mol |
| Molecular Formula | C15H202D4N2O |
| Exact Mass | 252.21397 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FTduhE4kKdQ |
|---|---|
| Name | 11,12,13,14-tetra-D(4)-allomatrine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H20D4N2O |
| InChI | InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15+/m0/s1/i1D,6D,7D,13D/t1?,6?,7?,11-,12+,13+,15+ |
| InChIKey | ZSBXGIUJOOQZMP-DOGBUHTCSA-N |
| Molecular Weight | 252.394 g/mol |
| SMILES | [C@]12(N(C[C@]3([C@]4(N(CCC[C@]24[H])CCC3)[H])[H])C(C(C(C1[2D])[2D])[2D])=O)[2D] |
| SPLASH | splash10-0udi-9870000000-bbca4f9878ee5e937ad0 |
| Source of Spectrum | HC-10-223-0 |
| Wiley ID | 1251502 |