(+)-Absouline

(+)-Absouline

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Catalog Number ACM112513334
CAS Number 112513-33-4
Structure
Molecular Weight 286.37
InChI InChI=1S/C17H22N2O2/c1-21-14-7-4-13(5-8-14)6-9-17(20)18-15-10-12-19-11-2-3-16(15)19/h4-9,15-16H,2-3,10-12H2,1H3,(H,18,20)/b9-6+/t15-,16+/m1/s1
InChI Key SBFIICJNXKHXND-GRLYAWNKSA-N
Purity 95%+
Complexity 388
Covalently-Bonded Unit Count 1
Defined Atom Stereocenter Count 2
Exact Mass 286.168127949
Heavy Atom Count 21
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
Isomeric SMILES COC1=CC=C(C=C1)/C=C/C(=O)N[C@@H]2CCN3[C@H]2CCC3
Monoisotopic Mass 286.168127949
PhysicalState Powder
Rotatable Bond Count 4
Topological Polar Surface Area 41.6 Ų

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