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2-(hexan-2-yl)-5-methyl-N-(quinolin-8-yl)benzamide
SpectraBase Compound ID a1SpfOJG33
InChI InChI=1S/C23H26N2O/c1-4-5-8-17(3)19-13-12-16(2)15-20(19)23(26)25-21-11-6-9-18-10-7-14-24-22(18)21/h6-7,9-15,17H,4-5,8H2,1-3H3,(H,25,26)
InChIKey KSKFBUFSSKWVCZ-UHFFFAOYSA-N
Mol Weight 346.47 g/mol
Molecular Formula C23H26N2O
Exact Mass 346.204513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDJgL8Y3sHC
Name 2-(hexan-2-yl)-5-methyl-N-(quinolin-8-yl)benzamide
Appearance Colorless oil
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Exact Mass 346.204513464 u
Formula C23H26N2O
InChI InChI=1S/C23H26N2O/c1-4-5-8-17(3)19-13-12-16(2)15-20(19)23(26)25-21-11-6-9-18-10-7-14-24-22(18)21/h6-7,9-15,17H,4-5,8H2,1-3H3,(H,25,26)
InChIKey KSKFBUFSSKWVCZ-UHFFFAOYSA-N
Instrument Name JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201901300
Molecular Weight 346.474 g/mol
Quality 142
Reported Formula C23H26N2O
SMILES N(C(C1=C(C(C)CCCC)C=CC(=C1)C)=O)C1=CC=CC2=C1N=CC=C2
SPLASH splash10-0002-0922000000-17511e54affd6a9dc508
Sample Comments linear:branched = 84:16
Source of Spectrum QE-25-SM15-2ma-2 (DOI: 10.1002/chem.201901300)
Thin-Layer Chromatography 0.31 (hexane/EtOAc, 10:1)
Wiley ID 1891492