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Piperazine, 1-ethoxycarbonyl-4-(2-fluorobenzoylaminothiocarbonyl)-

View entire compound with spectra: 1 NMR

Piperazine, 1-ethoxycarbonyl-4-(2-fluorobenzoylaminothiocarbonyl)-
SpectraBase Compound ID 8nKcaE7zUUv
InChI InChI=1S/C15H18FN3O3S/c1-2-22-15(21)19-9-7-18(8-10-19)14(23)17-13(20)11-5-3-4-6-12(11)16/h3-6H,2,7-10H2,1H3,(H,17,20,23)
InChIKey XRTKYYNUQJBWJL-UHFFFAOYSA-N
Mol Weight 339.39 g/mol
Molecular Formula C15H18FN3O3S
Exact Mass 339.105291 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AYOJx2rIVKp
Name Piperazine, 1-ethoxycarbonyl-4-(2-fluorobenzoylaminothiocarbonyl)-
Comments Computed using HOSE algorithm
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Exact Mass 339.105290786 u
Formula C15H18FN3O3S
InChI InChI=1S/C15H18FN3O3S/c1-2-22-15(21)19-9-7-18(8-10-19)14(23)17-13(20)11-5-3-4-6-12(11)16/h3-6H,2,7-10H2,1H3,(H,17,20,23)
InChIKey XRTKYYNUQJBWJL-UHFFFAOYSA-N
Molecular Weight 339.385 g/mol
SMILES C1CN(C(=S)NC(C2=CC=CC=C2F)=O)CCN1C(OCC)=O