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6H,8H-Isoquino[2,3-c][1,3]benzothiazin-8-one, 13,13a-dihydro-13-hydroxy-2,3-dimethoxy-, cis-(.+-.)-
SpectraBase Compound ID FDCZPiMOdYj
InChI InChI=1S/C18H17NO4S/c1-22-13-7-12-15(8-14(13)23-2)24-9-19-16(12)17(20)10-5-3-4-6-11(10)18(19)21/h3-8,16-17,20H,9H2,1-2H3/t16-,17+/m0/s1
InChIKey IUIZEHUEXWKAHM-DLBZAZTESA-N
Mol Weight 343.4 g/mol
Molecular Formula C18H17NO4S
Exact Mass 343.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID gjFHw4HR2c
Name 6H,8H-Isoquino[2,3-c][1,3]benzothiazin-8-one, 13,13a-dihydro-13-hydroxy-2,3-dimethoxy-, cis-(.+-.)-
CAS Registry Number 94936-13-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO4S
InChI InChI=1S/C18H17NO4S/c1-22-13-7-12-15(8-14(13)23-2)24-9-19-16(12)17(20)10-5-3-4-6-11(10)18(19)21/h3-8,16-17,20H,9H2,1-2H3/t16-,17+/m0/s1
InChIKey IUIZEHUEXWKAHM-DLBZAZTESA-N
Molecular Weight 343.397 g/mol
SMILES O[C@]1([C@]2(N(C(c3c1cccc3)=O)CSc1cc(OC)c(cc21)OC)[H])[H]
SPLASH splash10-03di-0192000000-e26f57887a1cb74b105a
Source of Spectrum I-62-2684-0
Synonyms (13R,13aS)-13-hydroxy-2,3-dimethoxy-13,13a-dihydro-8H-isoquino[2,3-c][1,3]benzothiazin-8-one trans-13-hydroxy-2,3-dimethoxy-8-oxo-5-thia-tetrahydroproto-berberine
Wiley ID 1337230