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Benzamide, 3-chloro-2-fluoro-N-butyl-N-octadecyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

Benzamide, 3-chloro-2-fluoro-N-butyl-N-octadecyl-
SpectraBase Compound ID DkKyGcx8xNo
InChI InChI=1S/C29H49ClFNO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-32(24-6-4-2)29(33)26-22-21-23-27(30)28(26)31/h21-23H,3-20,24-25H2,1-2H3
InChIKey TVSXJDPJAFHKQB-UHFFFAOYSA-N
Mol Weight 482.2 g/mol
Molecular Formula C29H49ClFNO
Exact Mass 481.348671 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HmgifFwvYH8
Name Benzamide, 3-chloro-2-fluoro-N-butyl-N-octadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 481.348671064 u
Formula C29H49ClFNO
InChI InChI=1S/C29H49ClFNO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-32(24-6-4-2)29(33)26-22-21-23-27(30)28(26)31/h21-23H,3-20,24-25H2,1-2H3
InChIKey TVSXJDPJAFHKQB-UHFFFAOYSA-N
Molecular Weight 482.168 g/mol
SMILES C1=CC=C(C(=C1Cl)F)C(N(CCCC)CCCCCCCCCCCCCCCCCC)=O