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(4-Chlorophenyl)(10-phenylphenanthren-9-yl)sulfane
SpectraBase Compound ID CXOxYRnWqU1
InChI InChI=1S/C26H17ClS/c27-19-14-16-20(17-15-19)28-26-24-13-7-5-11-22(24)21-10-4-6-12-23(21)25(26)18-8-2-1-3-9-18/h1-17H
InChIKey OVXDEFSGMKIZRP-UHFFFAOYSA-N
Mol Weight 396.94 g/mol
Molecular Formula C26H17ClS
Exact Mass 396.073949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvsyGGAFXGh
Name (4-Chlorophenyl)(10-phenylphenanthren-9-yl)sulfane
Appearance Yellow solid
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Exact Mass 396.073949421 u
Formula C26H17ClS
InChI InChI=1S/C26H17ClS/c27-19-14-16-20(17-15-19)28-26-24-13-7-5-11-22(24)21-10-4-6-12-23(21)25(26)18-8-2-1-3-9-18/h1-17H
InChIKey OVXDEFSGMKIZRP-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1021/jo302634n
Molecular Weight 396.935 g/mol
Reported Formula C26H17ClS
SMILES C1=CC2=C(C=C1)C(=C(C1=C2C=CC=C1)C1=CC=CC=C1)SC1=CC=C(C=C1)Cl
SPLASH splash10-0002-0049000000-9f686b31d3461d75c14d
Source of Spectrum JOC-78-1303-5 (DOI: 10.1021/jo302634n)
Wiley ID 1912208