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N-(2-(Benzylamino)-2-oxoethyl)-2-(N-(4-fluorobenzyl)acetamido)-2-phenylacetamide
SpectraBase Compound ID 7RGuStk7Lo1
InChI InChI=1S/C26H26FN3O3/c1-19(31)30(18-21-12-14-23(27)15-13-21)25(22-10-6-3-7-11-22)26(33)29-17-24(32)28-16-20-8-4-2-5-9-20/h2-15,25H,16-18H2,1H3,(H,28,32)(H,29,33)
InChIKey JTIXGAVFZOPAFU-UHFFFAOYSA-N
Mol Weight 447.51 g/mol
Molecular Formula C26H26FN3O3
Exact Mass 447.19582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4GciPr7KRk
Name N-(2-(Benzylamino)-2-oxoethyl)-2-(N-(4-fluorobenzyl)acetamido)-2-phenylacetamide
Appearance Colorless crystals
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Formula C26H26FN3O3
InChI InChI=1S/C26H26FN3O3/c1-19(31)30(18-21-12-14-23(27)15-13-21)25(22-10-6-3-7-11-22)26(33)29-17-24(32)28-16-20-8-4-2-5-9-20/h2-15,25H,16-18H2,1H3,(H,28,32)(H,29,33)
InChIKey JTIXGAVFZOPAFU-UHFFFAOYSA-N
Instrument Name Finnigan MAT TSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900198
Molecular Weight 447.510 g/mol
SMILES N(C(C(c1ccccc1)N(C(C)=O)Cc1ccc(cc1)F)=O)CC(NCc1ccccc1)=O
SPLASH splash10-0a4i-1960000000-9062ada50c54cebc73ca
Source of Spectrum U1-2019-SM15-7d
Thin-Layer Chromatography Rf = 0.25 (ethyl acetate)
Wiley ID 1846026