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Benzamide, 2,5-difluoro-N-(2-butyl)-N-hexadecyl-
SpectraBase Compound ID 8GcT2pppTCI
InChI InChI=1S/C27H45F2NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-21-30(23(3)5-2)27(31)25-22-24(28)19-20-26(25)29/h19-20,22-23H,4-18,21H2,1-3H3
InChIKey SOXVBVDLNNMYNV-UHFFFAOYSA-N
Mol Weight 437.7 g/mol
Molecular Formula C27H45F2NO
Exact Mass 437.346921 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CP8MZ5CD9bU
Name Benzamide, 2,5-difluoro-N-(2-butyl)-N-hexadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 437.346921398 u
Formula C27H45F2NO
InChI InChI=1S/C27H45F2NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-21-30(23(3)5-2)27(31)25-22-24(28)19-20-26(25)29/h19-20,22-23H,4-18,21H2,1-3H3
InChIKey SOXVBVDLNNMYNV-UHFFFAOYSA-N
Molecular Weight 437.660 g/mol
SMILES C(N(CCCCCCCCCCCCCCCC)C(CC)C)(=O)C=1C(F)=CC=C(F)C1