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3-bicyclo[1.1.1]pentanyl-(2-methoxyphenyl)imino-oxo-phenyl-.lambda.(6)-sulfane
SpectraBase Compound ID 60RTWhykYwj
InChI InChI=1S/C18H19NO2S/c1-21-17-10-6-5-9-16(17)19-22(20,15-7-3-2-4-8-15)18-11-14(12-18)13-18/h2-10,14H,11-13H2,1H3
InChIKey OTBJFGYJFMXNPI-UHFFFAOYSA-N
Mol Weight 313.42 g/mol
Molecular Formula C18H19NO2S
Exact Mass 313.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DL5ScpO4XS
Name 3-bicyclo[1.1.1]pentanyl-(2-methoxyphenyl)imino-oxo-phenyl-.lambda.(6)-sulfane
Appearance Colourless oil
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Formula C18H19NO2S
InChI InChI=1S/C18H19NO2S/c1-21-17-10-6-5-9-16(17)19-22(20,15-7-3-2-4-8-15)18-11-14(12-18)13-18/h2-10,14H,11-13H2,1H3
InChIKey OTBJFGYJFMXNPI-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201901453
Molecular Weight 313.415 g/mol
Reported Formula C18H19NO2(32)S
SMILES c1(N=S(=O)(c2ccccc2)C23CC(C3)C2)c(OC)cccc1
SPLASH splash10-0229-4905000000-9e9f3e7bc0901257dd14
Source of Spectrum ASC-362-SM22-10l
Thin-Layer Chromatography Rf = 0.26 (cHex/EtOAc, 5:1)
Wiley ID 1839413