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4-Methylthiazole
SpectraBase Compound ID J4ggWLfHAcl
InChI InChI=1S/C4H5NS/c1-4-2-6-3-5-4/h2-3H,1H3
InChIKey QMHIMXFNBOYPND-UHFFFAOYSA-N
Mol Weight 99.15 g/mol
Molecular Formula C4H5NS
Exact Mass 99.01427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kib6ecY062J
Name Thiazole <4-methyl->
CAS Registry Number 693-95-8
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 99.014270339 u
Formula C4H5NS
InChI InChI=1S/C4H5NS/c1-4-2-6-3-5-4/h2-3H,1H3
InChIKey QMHIMXFNBOYPND-UHFFFAOYSA-N
Molecular Weight 99.151 g/mol
Number of Peaks 47
RI1 827
RI2 484
RI3 682
RI4 636
SMILES c1scc(n1)C
SPLASH splash10-00dj-9000000000-40200d5dac4f870f6091
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Thiazole, 4-methyl-
Wiley ID LM_FFNSC3_1018