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Senecionine N-oxide
SpectraBase Compound ID L0KBPMvmVAq
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-CZDPUANDSA-N
Mol Weight 351.4 g/mol
Molecular Formula C18H25NO6
Exact Mass 351.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lo0fLDLJal8
Name Senecionine - N-oxide
Alternate Name(s) (4aR,7Z,9R,10S,13bR)-7-ethylidene-10-hydroxy-9,10-dimethyl-2,3,4,4a,7,8,9,10,13,13b-decahydro-5,12-dioxa-2a-azacyclododeca[cd]pentalene-6,11-dione 2a-oxide 12-Hydroxysenecionan-11,16-dione-N-oxide
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Formula C18H25NO6
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-CZDPUANDSA-N
Molecular Weight 351.399 g/mol
SMILES OC1(C(OCC=2[C@]3([N+](CC2)(CC[C@]3(OC(\C(C[C@]1(C)[H])=C/C)=O)[H])[O-])[H])=O)C
SPLASH splash10-014i-2900000000-572066eb76113b76ead9
Source of Spectrum Y4-87-389-2
Wiley ID 1550252