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2-(Methylthio)pyrazine
SpectraBase Compound ID H7kKhEpQsRL
InChI InChI=1S/C5H6N2S/c1-8-5-4-6-2-3-7-5/h2-4H,1H3
InChIKey KBPBOWBQRUXMFV-UHFFFAOYSA-N
Mol Weight 126.18 g/mol
Molecular Formula C5H6N2S
Exact Mass 126.025169 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KsufAykQcVA
Name Methylthiopyrazine
CAS Registry Number 21948-70-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6N2S
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C5H6N2S/c1-8-5-4-6-2-3-7-5/h2-4H,1H3
InChIKey KBPBOWBQRUXMFV-UHFFFAOYSA-N
Molecular Weight 126.177 g/mol
SMILES c1c(nccn1)SC
SPLASH splash10-0059-9300000000-4191e75952dca4fe645e
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Pyrazine
Wiley ID 1886946