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2-(Methylthio)-3-tridecylpyrazine
SpectraBase Compound ID L7QcPZobjgb
InChI InChI=1S/C18H32N2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-18(21-2)20-16-15-19-17/h15-16H,3-14H2,1-2H3
InChIKey GKXUHYXNFRYILM-UHFFFAOYSA-N
Mol Weight 308.5 g/mol
Molecular Formula C18H32N2S
Exact Mass 308.22862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 833guvFSJyS
Name 2-(Methylthio)-3-tridecylpyrazine
Appearance Slightly yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H32N2S
InChI InChI=1S/C18H32N2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-18(21-2)20-16-15-19-17/h15-16H,3-14H2,1-2H3
InChIKey GKXUHYXNFRYILM-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890-5793N or Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202003392
Reported Formula C18H32N2S
SMILES c1nc(c(nc1)CCCCCCCCCCCCC)SC
SPLASH splash10-0006-0900000000-89652a898d6443440908
Source of Spectrum ACI-59-SM54-11im
Wiley ID 1858129