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(7S,7aR,14S,14aS)-Tetradecahydro-7,14-methanodipyrido[1,2-a:1',2'-e][1,5]diazocine

Catalog Number ACM90391-1
CAS 90-39-1
Structure (7S,7aR,14S,14aS)-Tetradecahydro-7,14-methanodipyrido[1,2-a:1',2'-e][1,5]diazocine
Synonyms (-)-Sparteine; lupinidine
IUPAC Name (1S,2R,9S,10S)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecane
Molecular Weight 234.38
Molecular Formula C15H26N2
Canonical SMILES C1CCN2CC3CC(C2C1)CN4C3CCCC4
InChI SLRCCWJSBJZJBV-ZQDZILKHSA-N
InChI Key InChI=1S/C15H26N2/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17/h12-15H,1-11H2/t12-,13-,14-,15+/m0/s1
Boiling Point 137-138 °C at 1mmHg-lit.
Melting Point 30.5 °C
Purity 98%+
EC Number 201-988-8; 917-341-4
Exact Mass 234.209598838
Heavy Atom Count 17
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
Isomeric SMILES C1CCN2C[C@@H]3C[C@H]([C@H]2C1)CN4[C@H]3CCCC4
Monoisotopic Mass 234.209598838
Rotatable Bond Count 0
Topological Polar Surface Area 6.5 Ų

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