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Benzamide, 2-trifluoromethyl-N-(2-butyl)-N-nonyl-
SpectraBase Compound ID C2WaXyRSBt1
InChI InChI=1S/C21H32F3NO/c1-4-6-7-8-9-10-13-16-25(17(3)5-2)20(26)18-14-11-12-15-19(18)21(22,23)24/h11-12,14-15,17H,4-10,13,16H2,1-3H3
InChIKey PYIPMUCBLUKFCU-UHFFFAOYSA-N
Mol Weight 371.5 g/mol
Molecular Formula C21H32F3NO
Exact Mass 371.243599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8hvU3ZmGb0g
Name Benzamide, 2-trifluoromethyl-N-(2-butyl)-N-nonyl-
Comments Computed using HOSE algorithm
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Exact Mass 371.243599142 u
Formula C21H32F3NO
InChI InChI=1S/C21H32F3NO/c1-4-6-7-8-9-10-13-16-25(17(3)5-2)20(26)18-14-11-12-15-19(18)21(22,23)24/h11-12,14-15,17H,4-10,13,16H2,1-3H3
InChIKey PYIPMUCBLUKFCU-UHFFFAOYSA-N
Molecular Weight 371.488 g/mol
SMILES C(=O)(N(CCCCCCCCC)C(CC)C)C=1C(C(F)(F)F)=CC=CC1