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Scopolamine methyl bromide
SpectraBase Compound ID FYgQwI9GmAs
InChI InChI=1S/C18H24NO4.BrH/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11;/h3-7,12-17,20H,8-10H2,1-2H3;1H/q+1;/p-1/t12-,13-,14-,15+,16-,17+;/m1./s1
InChIKey CXYRUNPLKGGUJF-RAFJPFSSSA-M
Mol Weight 398.3 g/mol
Molecular Formula C18H24BrNO4
Exact Mass 397.088871 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Qk1AqmcaDz
Name 6 beta, 7 beta-epoxy-3 alpha-hydroxy-8-methyl-1 alphaH, 5 alpha H-tropanium bromide, (-)-tropate (ester)
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Formula C18H24BrNO4
InChI InChI=1S/C18H24NO4.BrH/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11;/h3-7,12-17,20H,8-10H2,1-2H3;1H/q+1;/p-1/t12-,13-,14-,15+,16-,17+;/m1./s1
InChIKey CXYRUNPLKGGUJF-RAFJPFSSSA-M
Instrument Name Varian CFT-20
Sadtler NMR Number 39753M
Solvent Polysol