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(10-Hexylphenanthren-9-yl)(phenyl)sulfane
SpectraBase Compound ID 1mEFjPgOxMB
InChI InChI=1S/C26H26S/c1-2-3-4-8-18-24-22-16-10-9-15-21(22)23-17-11-12-19-25(23)26(24)27-20-13-6-5-7-14-20/h5-7,9-17,19H,2-4,8,18H2,1H3
InChIKey VWXURBMAPCEEKU-UHFFFAOYSA-N
Mol Weight 370.55 g/mol
Molecular Formula C26H26S
Exact Mass 370.175522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tYbc3uENPe
Name (10-Hexylphenanthren-9-yl)(phenyl)sulfane
Appearance Yellow oil
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Exact Mass 370.175522011 u
Formula C26H26S
InChI InChI=1S/C26H26S/c1-2-3-4-8-18-24-22-16-10-9-15-21(22)23-17-11-12-19-25(23)26(24)27-20-13-6-5-7-14-20/h5-7,9-17,19H,2-4,8,18H2,1H3
InChIKey VWXURBMAPCEEKU-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1021/jo302634n
Molecular Weight 370.554 g/mol
Reported Formula C26H26S
SMILES C1=CC2=C(C=C1)C(=C(C1=C2C=CC=C1)CCCCCC)SC1=CC=CC=C1
SPLASH splash10-00di-0019000000-ab695699141230f31685
Source of Spectrum JOC-78-1304-17 (DOI: 10.1021/jo302634n)
Wiley ID 1912200