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Naphthalen-2-yl(octadecyl)sulfane
SpectraBase Compound ID 7EY4UHvjQH1
InChI InChI=1S/C28H44S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-29-28-23-22-26-20-17-18-21-27(26)25-28/h17-18,20-23,25H,2-16,19,24H2,1H3
InChIKey LMIXQYAGWZATQI-UHFFFAOYSA-N
Mol Weight 412.7 g/mol
Molecular Formula C28H44S
Exact Mass 412.316373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Mos5RaymFA
Name Naphthalen-2-yl(octadecyl)sulfane
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.316372591 u
Formula C28H44S
InChI InChI=1S/C28H44S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-29-28-23-22-26-20-17-18-21-27(26)25-28/h17-18,20-23,25H,2-16,19,24H2,1H3
InChIKey LMIXQYAGWZATQI-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201705842
Molecular Weight 412.720 g/mol
Quality 47
SMILES C1=CC2=C(C=C1)C=CC(=C2)SCCCCCCCCCCCCCCCCCC
SPLASH splash10-03di-0900100000-64f5a534e2521c27f952
Source of Spectrum QE-24-SM9-5j (DOI: 10.1002/chem.201705842)
Wiley ID 1901425