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2-(Cyclohexylethyl)(dodecyl)sulfane

View entire compound with spectra: 1 MS (GC)

2-(Cyclohexylethyl)(dodecyl)sulfane
SpectraBase Compound ID Fg7M2FlXsSe
InChI InChI=1S/C20H40S/c1-2-3-4-5-6-7-8-9-10-14-18-21-19-17-20-15-12-11-13-16-20/h20H,2-19H2,1H3
InChIKey CKSCQYXJIBVQAR-UHFFFAOYSA-N
Mol Weight 312.6 g/mol
Molecular Formula C20H40S
Exact Mass 312.285072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LjrvGTlJEQN
Name 2-(Cyclohexylethyl)(dodecyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H40S
InChI InChI=1S/C20H40S/c1-2-3-4-5-6-7-8-9-10-14-18-21-19-17-20-15-12-11-13-16-20/h20H,2-19H2,1H3
InChIKey CKSCQYXJIBVQAR-UHFFFAOYSA-N
Instrument Name Thermo DSQII
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701692
Quality 83
SMILES C(CCCCCCCCCCC)SCCC1CCCCC1
SPLASH splash10-001i-9400000000-23dbf40857f0d8eb2c0d
Source of Spectrum K1-2018-733-3e (DOI: 10.1002/ejoc.201701692)
Wiley ID 1894441