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N-[2-(4-Fluorophenethyl)]-N'-[2-(4-bromophenethyl)]-thiourea

View entire compound with spectra: 2 NMR

N-[2-(4-Fluorophenethyl)]-N'-[2-(4-bromophenethyl)]-thiourea
SpectraBase Compound ID 2v8FxZmoBvd
InChI InChI=1S/C17H18BrFN2S/c18-15-5-1-13(2-6-15)9-11-20-17(22)21-12-10-14-3-7-16(19)8-4-14/h1-8H,9-12H2,(H2,20,21,22)
InChIKey CZVPYMFVWHMVDF-UHFFFAOYSA-N
Mol Weight 381.31 g/mol
Molecular Formula C17H18BrFN2S
Exact Mass 380.035811 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FylzIUfJkuf
Name N-[2-(4-Fluorophenethyl)]-N'-[2-(4-bromophenethyl)]-thiourea
Comments Computed using HOSE algorithm
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Exact Mass 380.035810925 u
Formula C17H18BrFN2S
InChI InChI=1S/C17H18BrFN2S/c18-15-5-1-13(2-6-15)9-11-20-17(22)21-12-10-14-3-7-16(19)8-4-14/h1-8H,9-12H2,(H2,20,21,22)
InChIKey CZVPYMFVWHMVDF-UHFFFAOYSA-N
Molecular Weight 381.307 g/mol
SMILES C1(F)=CC=C(CCNC(=S)NCCC2=CC=C(C=C2)Br)C=C1