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3-bicyclo[1.1.1]pentanyl-(4-nitrophenyl)imino-oxo-phenyl-.lambda.(6)-sulfane
SpectraBase Compound ID 8jd1WitPlHl
InChI InChI=1S/C17H16N2O3S/c20-19(21)15-8-6-14(7-9-15)18-23(22,16-4-2-1-3-5-16)17-10-13(11-17)12-17/h1-9,13H,10-12H2
InChIKey ALPYHDRJUBWTEY-UHFFFAOYSA-N
Mol Weight 328.39 g/mol
Molecular Formula C17H16N2O3S
Exact Mass 328.088164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOS4ekpbDWW
Name 3-bicyclo[1.1.1]pentanyl-(4-nitrophenyl)imino-oxo-phenyl-.lambda.(6)-sulfane
Appearance Yellow solid
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Formula C17H16N2O3S
InChI InChI=1S/C17H16N2O3S/c20-19(21)15-8-6-14(7-9-15)18-23(22,16-4-2-1-3-5-16)17-10-13(11-17)12-17/h1-9,13H,10-12H2
InChIKey ALPYHDRJUBWTEY-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201901453
Molecular Weight 328.386 g/mol
Reported Formula C17H16N2O3(32)S
SMILES c1(N=S(=O)(c2ccccc2)C23CC(C3)C2)ccc(cc1)[N+]([O-])=O
SPLASH splash10-004i-7901000000-fbef465e2aab20260ae5
Source of Spectrum ASC-362-SM19-10e
Thin-Layer Chromatography Rf = 0.23 (cHex/EtOAc, 10:1)
Wiley ID 1839407