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3-bicyclo[1.1.1]pentanyl-oxo-phenyl-(p-tolylimino)-.lambda.(6)-sulfane
SpectraBase Compound ID 9IXX5122u8U
InChI InChI=1S/C18H19NOS/c1-14-7-9-16(10-8-14)19-21(20,17-5-3-2-4-6-17)18-11-15(12-18)13-18/h2-10,15H,11-13H2,1H3
InChIKey XTDGJOUNMAGZAE-UHFFFAOYSA-N
Mol Weight 297.42 g/mol
Molecular Formula C18H19NOS
Exact Mass 297.118735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBvaofkZJE2
Name 3-bicyclo[1.1.1]pentanyl-oxo-phenyl-(p-tolylimino)-.lambda.(6)-sulfane
Appearance Yellow solid
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Formula C18H19NOS
InChI InChI=1S/C18H19NOS/c1-14-7-9-16(10-8-14)19-21(20,17-5-3-2-4-6-17)18-11-15(12-18)13-18/h2-10,15H,11-13H2,1H3
InChIKey XTDGJOUNMAGZAE-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201901453
Molecular Weight 297.416 g/mol
Reported Formula C18H19NO(32)S
SMILES c1(N=S(=O)(c2ccccc2)C23CC(C3)C2)ccc(cc1)C
SPLASH splash10-0a4i-2910000000-285ee4890876a522e095
Source of Spectrum ASC-362-SM18-10b
Thin-Layer Chromatography Rf = 0.19 (cHex/EtOAc, 10:1)
Wiley ID 1839404