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4-DICHLORO-ACETYL-3-METHYLTHIO-4H-1,4-BENZOTHIAZINE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-DICHLORO-ACETYL-3-METHYLTHIO-4H-1,4-BENZOTHIAZINE
SpectraBase Compound ID IHco8Z4PtUm
InChI InChI=1S/C11H9Cl2NOS2/c1-16-9-6-17-8-5-3-2-4-7(8)14(9)11(15)10(12)13/h2-6,10H,1H3
InChIKey MGABHNBQDACTHU-UHFFFAOYSA-N
Mol Weight 306.23 g/mol
Molecular Formula C11H9Cl2NOS2
Exact Mass 304.950262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lU7zPUkgf3
Name 2,2-bis(chloranyl)-1-(3-methylsulfanyl-1,4-benzothiazin-4-yl)ethanone
Alternate Name(s) 2,2-dichloro-1-(3-methylsulfanyl-1,4-benzothiazin-4-yl)ethanone 2,2-dichloro-1-[3-(methylthio)-1,4-benzothiazin-4-yl]ethanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9Cl2NOS2
InChI InChI=1S/C11H9Cl2NOS2/c1-16-9-6-17-8-5-3-2-4-7(8)14(9)11(15)10(12)13/h2-6,10H,1H3
InChIKey MGABHNBQDACTHU-UHFFFAOYSA-N
Molecular Weight 306.225 g/mol
SMILES C(N1C(=CSc2c1cccc2)SC)(C(Cl)Cl)=O
SPLASH splash10-0006-0902000000-3e61c269a84ab426b514
Source of Spectrum Y-34-825-12
Wiley ID 1307122