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4-(1-Chlorodifluoromethyl)-8-methylpyrimido[2,1-b]benzothiazole-2-one
SpectraBase Compound ID 2dU3yIa3LYL
InChI InChI=1S/C12H7ClF2N2OS/c1-6-2-3-7-8(4-6)19-11-16-9(12(13,14)15)5-10(18)17(7)11/h2-5H,1H3
InChIKey QPXMGJYWOWENMB-UHFFFAOYSA-N
Mol Weight 300.71 g/mol
Molecular Formula C12H7ClF2N2OS
Exact Mass 299.993568 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EifLobikhpL
Name 4-(1-Chlorodifluoromethyl)-8-methylpyrimido[2,1-b]benzothiazole-2-one
Alternate Name(s) 2-(1-Chlorodifluoromethyl)-8-methyl-4H-pyrimido[2,1-b][1,3]benzothiazole-4-one 4-[chloro(difluoro)methyl]-8-methyl-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one 2-[chloro(difluoro)methyl]-8-methyl-4-pyrimido[2,1-b][1,3]benzothiazolone 2-[chloro(difluoro)methyl]-8-methylpyrimido[2,1-b][1,3]benzothiazol-4-one 2-[chloranyl-bis(fluoranyl)methyl]-8-methyl-pyrimido[2,1-b][1,3]benzothiazol-4-one
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Formula C12H7ClF2N2OS
InChI InChI=1S/C12H7ClF2N2OS/c1-6-2-3-7-8(4-6)19-11-16-9(12(13,14)15)5-10(18)17(7)11/h2-5H,1H3
InChIKey QPXMGJYWOWENMB-UHFFFAOYSA-N
Molecular Weight 300.711 g/mol
SMILES C1=2N(C(C=C(N2)C(Cl)(F)F)=O)c2c(S1)cc(cc2)C
SPLASH splash10-0udr-0089000000-5f246df880e0def2a56d
Source of Spectrum KC-0-986-8
Wiley ID 787811