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Benzamide, 3-fluoro-N-benzyl-N-(2-ethylhexyl)-
SpectraBase Compound ID 3X3Aoe9TKdd
InChI InChI=1S/C22H28FNO/c1-3-5-10-18(4-2)16-24(17-19-11-7-6-8-12-19)22(25)20-13-9-14-21(23)15-20/h6-9,11-15,18H,3-5,10,16-17H2,1-2H3
InChIKey WQXFMIVUQLFGBG-UHFFFAOYSA-N
Mol Weight 341.47 g/mol
Molecular Formula C22H28FNO
Exact Mass 341.215493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LIvikJHRRcF
Name Benzamide, 3-fluoro-N-benzyl-N-(2-ethylhexyl)-
Comments Computed using HOSE algorithm
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Exact Mass 341.215492688 u
Formula C22H28FNO
InChI InChI=1S/C22H28FNO/c1-3-5-10-18(4-2)16-24(17-19-11-7-6-8-12-19)22(25)20-13-9-14-21(23)15-20/h6-9,11-15,18H,3-5,10,16-17H2,1-2H3
InChIKey WQXFMIVUQLFGBG-UHFFFAOYSA-N
Molecular Weight 341.470 g/mol
SMILES C1=CC=C(C=C1F)C(N(CC(CCCC)CC)CC1=CC=CC=C1)=O