SpectraBase Compound ID | 8VMThRKvrIr |
---|---|
InChI | InChI=1S/C20H22N2O2/c1-3-19-10-22(2)16-11-9-24-15(8-13(11)19)20(17(16)19)12-6-4-5-7-14(12)21-18(20)23/h3-7,11,13,15-17H,1,8-10H2,2H3,(H,21,23)/t11-,13+,15+,16+,17-,19-,20-/m0/s1 |
InChIKey | NFYYATWFXNPTRM-QJICHLCESA-N |
Mol Weight | 322.41 g/mol |
Molecular Formula | C20H22N2O2 |
Exact Mass | 322.168128 g/mol |
SpectraBase Spectrum ID | 2Tbv9lMO6sQ |
---|---|
Name | Gelsemine |
Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
Formula | C20H21N2O2 |
InChI | InChI=1S/C20H22N2O2/c1-3-19-10-22(2)16-11-9-24-15(8-13(11)19)20(17(16)19)12-6-4-5-7-14(12)21-18(20)23/h3-7,11,13,15-17H,1,8-10H2,2H3,(H,21,23)/t11-,13+,15+,16+,17-,19-,20-/m0/s1 |
InChIKey | NFYYATWFXNPTRM-QJICHLCESA-N |
SMILES | c1cc2c(cc1)[C@@]1(C(N2)=O)[C@@]2([C@@]3([C@@]4(C[C@]1(OC[C@@]4([C@]2(N(C3)C)[H])[H])[H])[H])C=C)[H] |
SPLASH | splash10-05i0-4953000000-163db520f309504a8376 |
Source of Spectrum | Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |