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N-BUTYL-4-METHOXYPHENYL-SULFIDE
SpectraBase Compound ID 8ZRX4zox2rG
InChI InChI=1S/C11H16OS/c1-3-4-9-13-11-7-5-10(12-2)6-8-11/h5-8H,3-4,9H2,1-2H3
InChIKey VRLFLNBBUBWJEV-UHFFFAOYSA-N
Mol Weight 196.31 g/mol
Molecular Formula C11H16OS
Exact Mass 196.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1SgjYT3iIy
Name butyl(4-methoxyphenyl)sulfane
Appearance Colourless liquid
Carrier Gas Nitrogen
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Exact Mass 196.092186308 u
Formula C11H16OS
InChI InChI=1S/C11H16OS/c1-3-4-9-13-11-7-5-10(12-2)6-8-11/h5-8H,3-4,9H2,1-2H3
InChIKey VRLFLNBBUBWJEV-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201709553
Molecular Weight 196.308 g/mol
Quality 79
Reported Formula C11H16OS
SMILES C(CCC)SC1=CC=C(C=C1)OC
SPLASH splash10-0007-0900000000-7fd9ec8855f7919947aa
Source of Spectrum ACI-56-SM13-5i (DOI: 10.1002/anie.201709553)
Thin-Layer Chromatography 0.50 (SiO2, i-hexane/EtOAc, 99:1)
Wiley ID 1896766