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Demethylmaritidine
SpectraBase Compound ID 1TWbay5a1D9
InChI InChI=1S/C16H19NO3/c1-20-14-6-10-9-17-5-4-16(12(10)8-13(14)19)3-2-11(18)7-15(16)17/h2-3,6,8,11,15,18-19H,4-5,7,9H2,1H3/t11-,15+,16+/m1/s1
InChIKey HMGRRBMNYQOSEF-RLCCDNCMSA-N
Mol Weight 273.33 g/mol
Molecular Formula C16H19NO3
Exact Mass 273.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33miPf2rBY
Name Demethylmaritidine
Alternate Name(s) (3S,4aS,10bR)-8-methoxy-4,4a-dihydro-3H,6H-5,10b-ethanophenanthridine-3,9-diol
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Formula C16H19NO3
InChI InChI=1S/C16H19NO3/c1-20-14-6-10-9-17-5-4-16(12(10)8-13(14)19)3-2-11(18)7-15(16)17/h2-3,6,8,11,15,18-19H,4-5,7,9H2,1H3/t11-,15+,16+/m1/s1
InChIKey HMGRRBMNYQOSEF-RLCCDNCMSA-N
Literature Reference DOI 10.1002/pca.824
Molecular Weight 273.332 g/mol
SMILES Oc1c(cc2CN3[C@]4(C[C@@](C=C[C@@]4(c2c1)CC3)(O)[H])[H])OC
SPLASH splash10-0fk9-0590000000-721aaff13b4b8109ddf6
Source of Spectrum PA-16-101-8
Wiley ID 1789479