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N-(4-(2-Benzylphenoxy)butyl)-2,2,2-trifluoro-N-methylacetamide
SpectraBase Compound ID 1y9zvGjWdKh
InChI InChI=1S/C20H22F3NO2/c1-24(19(25)20(21,22)23)13-7-8-14-26-18-12-6-5-11-17(18)15-16-9-3-2-4-10-16/h2-6,9-12H,7-8,13-15H2,1H3
InChIKey ZHLYGLLWWIIESV-UHFFFAOYSA-N
Mol Weight 365.4 g/mol
Molecular Formula C20H22F3NO2
Exact Mass 365.160263 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9rug9eHIUY7
Name N-(4-(2-Benzylphenoxy)butyl)-2,2,2-trifluoro-N-methylacetamide
Comments Computed using HOSE algorithm
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Exact Mass 365.160263439 u
Formula C20H22F3NO2
InChI InChI=1S/C20H22F3NO2/c1-24(19(25)20(21,22)23)13-7-8-14-26-18-12-6-5-11-17(18)15-16-9-3-2-4-10-16/h2-6,9-12H,7-8,13-15H2,1H3
InChIKey ZHLYGLLWWIIESV-UHFFFAOYSA-N
Molecular Weight 365.396 g/mol
SMILES C1=CC=CC=C1CC1=C(C=CC=C1)OCCCCN(C)C(=O)C(F)(F)F