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4-[(4-bromophenoxy)methyl]-N-[1-(4-tert-butylphenyl)ethyl]benzamide
SpectraBase Compound ID 65s4qDo2q34
InChI InChI=1S/C26H28BrNO2/c1-18(20-9-11-22(12-10-20)26(2,3)4)28-25(29)21-7-5-19(6-8-21)17-30-24-15-13-23(27)14-16-24/h5-16,18H,17H2,1-4H3,(H,28,29)
InChIKey JYRYXIWAUCLPCY-UHFFFAOYSA-N
Mol Weight 466.42 g/mol
Molecular Formula C26H28BrNO2
Exact Mass 465.130342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GQpWWIfad9q
Name 4-[(4-Bromophenoxy)methyl]-N-[1-(4-tert-butylphenyl)ethyl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 465.130342144 u
Formula C26H28BrNO2
InChI InChI=1S/C26H28BrNO2/c1-18(20-9-11-22(12-10-20)26(2,3)4)28-25(29)21-7-5-19(6-8-21)17-30-24-15-13-23(27)14-16-24/h5-16,18H,17H2,1-4H3,(H,28,29)
InChIKey JYRYXIWAUCLPCY-UHFFFAOYSA-N
Molecular Weight 466.419 g/mol
SMILES N(C(C1=CC=C(C=C1)COC=1C=CC(=CC1)Br)=O)C(C=1C=CC(C(C)(C)C)=CC1)C