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(2-Methyl-10-phenylphenanthren-9-yl)(phenyl)sulfane
SpectraBase Compound ID H8KayJ4G6xD
InChI InChI=1S/C27H20S/c1-19-16-17-23-22-14-8-9-15-24(22)27(28-21-12-6-3-7-13-21)26(25(23)18-19)20-10-4-2-5-11-20/h2-18H,1H3
InChIKey YDQNTIALHDFHKE-UHFFFAOYSA-N
Mol Weight 376.52 g/mol
Molecular Formula C27H20S
Exact Mass 376.128572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KFjFOA1nwIU
Name (2-Methyl-10-phenylphenanthren-9-yl)(phenyl)sulfane
Appearance Yellow solid
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Formula C27H20S
InChI InChI=1S/C27H20S/c1-19-16-17-23-22-14-8-9-15-24(22)27(28-21-12-6-3-7-13-21)26(25(23)18-19)20-10-4-2-5-11-20/h2-18H,1H3
InChIKey YDQNTIALHDFHKE-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1021/jo302634n
Molecular Weight 376.517 g/mol
Reported Formula C27H20S
SMILES C=1C=CC=2C(SC=3C=CC=CC3)=C(C=3C=CC=CC3)C=3C=C(C)C=CC3C2C1
SPLASH splash10-004i-0039000000-139aacb9454f278b0c28
Source of Spectrum JOC-78-1304-18 (DOI: 10.1021/jo302634n)
Wiley ID 1912201