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3-bicyclo[1.1.1]pentanyl-oxo-phenyl-(6-quinolylimino)-.lambda.(6)-sulfane
SpectraBase Compound ID CbvT1FZCjF6
InChI InChI=1S/C20H18N2OS/c23-24(18-6-2-1-3-7-18,20-12-15(13-20)14-20)22-17-8-9-19-16(11-17)5-4-10-21-19/h1-11,15H,12-14H2
InChIKey FNQRKUPPIUXLJL-UHFFFAOYSA-N
Mol Weight 334.44 g/mol
Molecular Formula C20H18N2OS
Exact Mass 334.113984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSX0Y8CPgHk
Name 3-bicyclo[1.1.1]pentanyl-oxo-phenyl-(6-quinolylimino)-.lambda.(6)-sulfane
Appearance Brown solid
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Formula C20H18N2OS
InChI InChI=1S/C20H18N2OS/c23-24(18-6-2-1-3-7-18,20-12-15(13-20)14-20)22-17-8-9-19-16(11-17)5-4-10-21-19/h1-11,15H,12-14H2
InChIKey FNQRKUPPIUXLJL-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201901453
Molecular Weight 334.437 g/mol
Reported Formula C20H18N2O(32)S
SMILES c1(N=S(=O)(c2ccccc2)C23CC(C3)C2)cc2c(cc1)nccc2
SPLASH splash10-0006-6900000000-a5844bf7c73f3695dafd
Source of Spectrum ASC-362-SM23-10n
Thin-Layer Chromatography Rf = 0.17 (cHex/EtOAc, 3:1)
Wiley ID 1839415