SpectraBase Compound ID | 9bm8YA5VeH4 |
---|---|
InChI | InChI=1S/C11H15N3/c1-7-12-6-9-10(13-7)5-8-3-4-11(9)14(8)2/h6,8,11H,3-5H2,1-2H3/t8-,11?/m0/s1 |
InChIKey | HYFISAQQQSXPKP-YMNIQAILSA-N |
Mol Weight | 189.26 g/mol |
Molecular Formula | C11H15N3 |
Exact Mass | 189.126597 g/mol |
Enantiomer InChIKey | HYFISAQQQSXPKP-RZZZFEHKSA-N |
Title | Journal or Book | Year |
---|---|---|
An Analysis of the Binding of Cocaine Analogues to the Monoamine Transporters Using Tensor Decomposition 3-D QSAR | Bioorganic & Medicinal Chemistry | 2002 |
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