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13268-67-2

Name senecionine N-oxide
CAS 13268-67-2
Molecular Formula C18H25NO6
MDL Number MFCD01750097
Molecular Weight 351.39
MOL File 13268-67-2.mol
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Chemical Properties

form  Solid
pka 12.77±0.40(Predicted)
color  White to off-white
InChI InChI=1S/C18H25NO6/c1-4-12-9-11(2)18(3,22)17(21)24-10-13-5-7-19(23)8-6-14(15(13)19)25-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4-/t11-,14-,15-,18-,19?/m1/s1
InChIKey PLGBHVNNYDZWGZ-GPUZEBNTSA-N
SMILES [N+]12([O-])CC=C3COC(=O)[C@@](O)(C)[C@H](C)C/C(=C/C)/C(=O)O[C@@]([H])([C@]13[H])CC2

Safety Data

Symbol(GHS) 
GHS08,GHS06
Signal word  Danger
Hazard statements  H301-H373
Precautionary statements  P264-P270-P301+P310-P321-P330-P405-P501-P260-P314-P501
RIDADR  1544
HazardClass  6.1(a)
PackingGroup  II

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