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Methyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-4H-3,1-benzothiazine-7-carboxylate
SpectraBase Compound ID 10tug4Wp1aw
InChI InChI=1S/C20H18FN3O3S/c1-27-18(25)13-2-7-16-17(12-13)22-20(28-19(16)26)24-10-8-23(9-11-24)15-5-3-14(21)4-6-15/h2-7,12H,8-11H2,1H3
InChIKey ZZSNEDDXGMAXIU-UHFFFAOYSA-N
Mol Weight 399.44 g/mol
Molecular Formula C20H18FN3O3S
Exact Mass 399.105291 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XB23WSbGGf
Name Methyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-4H-3,1-benzothiazine-7-carboxylate
Alternate Name(s) 2-[4-(4-fluorophenyl)-1-piperazinyl]-4-oxo-3,1-benzothiazine-7-carboxylic acid methyl ester Methyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-3,1-benzothiazine-7-carboxylate Methyl 2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-3,1-benzothiazine-7-carboxylate
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Formula C20H18FN3O3S
InChI InChI=1S/C20H18FN3O3S/c1-27-18(25)13-2-7-16-17(12-13)22-20(28-19(16)26)24-10-8-23(9-11-24)15-5-3-14(21)4-6-15/h2-7,12H,8-11H2,1H3
InChIKey ZZSNEDDXGMAXIU-UHFFFAOYSA-N
Molecular Weight 399.440 g/mol
SMILES C=1(SC(c2ccc(C(=O)OC)cc2N1)=O)N1CCN(CC1)c1ccc(cc1)F
SPLASH splash10-0uk9-3910000000-e20337596493adefaf04
Source of Spectrum IY-2-4984-8
Wiley ID 1657831