(-)-Sparteine sulfate pentahydrate(6160-12-9) IR1
Molecular FormulaC15H28N2O4S
Molecular Weight332.46
InChIInChI=1/C15H26N2.H2O4S.5H2O/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17;1-5(2,3)4;;;;;/h12-15H,1-11H2;(H2,1,2,3,4);5*1H2/t12-,13-,14-,15+;;;;;;/s3
InChIKey WNSDDGBLIALDPB-JMGZJQNKNA-N
Smiles[C@@]12(CN3[C@]([H])(CCCC3)[C@]([H])(CN3CCCC[C@@]13[H])C2)[H].S(=O)(=O)(O)O.O.O.O.O.O |&1:0,3,9,17,r|
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Assign. Shift(ppm)
A *1 3.565
B 3.490
C 3.20
D *1 3.11
E 3.07
F *2 2.952
G 2.856
J 2.485
K *2 2.05 to 2.00
L *2 1.81 to 1.75
M *2 1.60
N *2 1.50 to 1.42
P *2 1.31
Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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Spectral Code: IR : KBr disc