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2-[(Z)-.alpha.-Chloro-4'-methoxybenzylidene]-4-(2'-dimethylaminoethyl)-2H-[1,4]benzothiazin-3(4H)-one
SpectraBase Compound ID CobDE3kJVMX
InChI InChI=1S/C20H21ClN2O2S/c1-22(2)12-13-23-16-6-4-5-7-17(16)26-19(20(23)24)18(21)14-8-10-15(25-3)11-9-14/h4-11H,12-13H2,1-3H3/b19-18-
InChIKey PDHVWAIMLMOZMV-HNENSFHCSA-N
Mol Weight 388.91 g/mol
Molecular Formula C20H21ClN2O2S
Exact Mass 388.101227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DgkEigjn06B
Name 2-[(Z)-.alpha.-Chloro-4'-methoxybenzylidene]-4-(2'-dimethylaminoethyl)-2H-[1,4]benzothiazin-3(4H)-one
CAS Registry Number 139564-98-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21ClN2O2S
InChI InChI=1S/C20H21ClN2O2S/c1-22(2)12-13-23-16-6-4-5-7-17(16)26-19(20(23)24)18(21)14-8-10-15(25-3)11-9-14/h4-11H,12-13H2,1-3H3/b19-18-
InChIKey PDHVWAIMLMOZMV-HNENSFHCSA-N
Molecular Weight 388.913 g/mol
SMILES C1(\C(Sc2c(N1CCN(C)C)cccc2)=C/(c1ccc(cc1)OC)Cl)=O
SPLASH splash10-0a4i-9000000000-96c1db086a2c268ededb
Source of Spectrum U-1992-405-10
Synonyms (2Z)-2-[chloro(4-methoxyphenyl)methylene]-4-[2-(dimethylamino)ethyl]-2H-1,4-benzothiazin-3(4H)-one
Wiley ID 764179