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2-dodecylsulfanylpropylcyclohexane
SpectraBase Compound ID 9dLB5ONDqm6
InChI InChI=1S/C21H42S/c1-3-4-5-6-7-8-9-10-11-15-18-22-20(2)19-21-16-13-12-14-17-21/h20-21H,3-19H2,1-2H3
InChIKey WZXFUBNPNAMUGR-UHFFFAOYSA-N
Mol Weight 326.6 g/mol
Molecular Formula C21H42S
Exact Mass 326.300723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pw5Ssgp1c
Name 2-dodecylsulfanylpropylcyclohexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.300722526 u
Formula C21H42S
InChI InChI=1S/C21H42S/c1-3-4-5-6-7-8-9-10-11-15-18-22-20(2)19-21-16-13-12-14-17-21/h20-21H,3-19H2,1-2H3
InChIKey WZXFUBNPNAMUGR-UHFFFAOYSA-N
Instrument Name Thermo DSQII
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701692
Molecular Weight 326.627 g/mol
Quality 79
SMILES C(CCCCCCCCCCC)SC(CC1CCCCC1)C
SPLASH splash10-00e9-8900000000-9d26f4efd4cffd433610
Source of Spectrum K1-2018-733-4f (DOI: 10.1002/ejoc.201701692)
Wiley ID 1894447