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1-(4-(2-Methyl-3-pentyl-1-tosyl-1,2-dihydroquinolin-4-yl)phenyl)propan-2-one
SpectraBase Compound ID 6uvhREj9sFw
InChI InChI=1S/C31H35NO3S/c1-5-6-7-10-28-24(4)32(36(34,35)27-19-13-22(2)14-20-27)30-12-9-8-11-29(30)31(28)26-17-15-25(16-18-26)21-23(3)33/h8-9,11-20,24H,5-7,10,21H2,1-4H3
InChIKey IOADFMSAOSMTJR-UHFFFAOYSA-N
Mol Weight 501.7 g/mol
Molecular Formula C31H35NO3S
Exact Mass 501.233765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsMudQepNAz
Name 1-(4-(2-Methyl-3-pentyl-1-tosyl-1,2-dihydroquinolin-4-yl)phenyl)propan-2-one
Appearance Colorless oil
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Formula C31H35NO3S
InChI InChI=1S/C31H35NO3S/c1-5-6-7-10-28-24(4)32(36(34,35)27-19-13-22(2)14-20-27)30-12-9-8-11-29(30)31(28)26-17-15-25(16-18-26)21-23(3)33/h8-9,11-20,24H,5-7,10,21H2,1-4H3
InChIKey IOADFMSAOSMTJR-UHFFFAOYSA-N
Instrument Name Finnigan SSQ
Ionization Type EI
Literature Reference DOI 10.1002/chem.201701255
Molecular Weight 501.685 g/mol
Reported Formula C31H35NO3S
SMILES C1=CC2=C(C=C1)N(C(C(=C2C1=CC=C(C=C1)CC(C)=O)CCCCC)C)S(C1=CC=C(C=C1)C)(=O)=O
SPLASH splash10-000i-0000900000-cd171f49a99895d70bf9
Source of Spectrum QE-23-SM10-3g (DOI: 10.1002/chem.201701255)
Thin-Layer Chromatography 0.20 (Hex/EtOAc, 5:1)
Wiley ID 1905778