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2-(3,4-dimethoxyphenyl)-N-methyl-N-[(4-phenyl-4H-pyrrolo[2,1-c][1,4]benzothiazin-1-yl)methyl]ethanamine
SpectraBase Compound ID LEvO6i2Ixfz
InChI InChI=1S/C29H30N2O2S/c1-30(18-17-21-13-16-26(32-2)27(19-21)33-3)20-23-14-15-25-29(22-9-5-4-6-10-22)34-28-12-8-7-11-24(28)31(23)25/h4-16,19,29H,17-18,20H2,1-3H3
InChIKey GOCVWDSOLCMADR-UHFFFAOYSA-N
Mol Weight 470.63 g/mol
Molecular Formula C29H30N2O2S
Exact Mass 470.202799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uddFNbuO8b
Name 2-(3,4-dimethoxyphenyl)-N-methyl-N-[(4-phenyl-4H-pyrrolo[2,1-c][1,4]benzothiazin-1-yl)methyl]ethanamine
Comments Less than 3 mono-isotopic peaks
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Formula C29H30N2O2S
InChI InChI=1S/C29H30N2O2S/c1-30(18-17-21-13-16-26(32-2)27(19-21)33-3)20-23-14-15-25-29(22-9-5-4-6-10-22)34-28-12-8-7-11-24(28)31(23)25/h4-16,19,29H,17-18,20H2,1-3H3
InChIKey GOCVWDSOLCMADR-UHFFFAOYSA-N
Molecular Weight 470.631 g/mol
SMILES c12[n](-c3c(SC2c2ccccc2)cccc3)c(cc1)CN(CCc1cc(OC)c(cc1)OC)C
SPLASH splash10-004i-0090000000-9dd5c0a92bac3594a858
Source of Spectrum E1-38-4404-10
Synonyms homoveratryl-methyl-[(4-phenyl-4H-pyrrolo[2,1-c][1,4]benzothiazin-1-yl)methyl]amine
Wiley ID 1598534