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2-Isobutyl-4,5-dimethyl-1,3-thiazole
SpectraBase Compound ID ItIOeNJadiW
InChI InChI=1S/C9H15NS/c1-6(2)5-9-10-7(3)8(4)11-9/h6H,5H2,1-4H3
InChIKey NSVPHVLZAKJSGV-UHFFFAOYSA-N
Mol Weight 169.29 g/mol
Molecular Formula C9H15NS
Exact Mass 169.092521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7DrZsYZTDE1
Name Thiazole <4,5-Dimethyl-2-isobutyl->
Source of Sample SAFC Cat.no. W362107
CAS Registry Number 53498-32-1
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 169.092520661 u
Formula C9H15NS
InChI InChI=1S/C9H15NS/c1-6(2)5-9-10-7(3)8(4)11-9/h6H,5H2,1-4H3
InChIKey NSVPHVLZAKJSGV-UHFFFAOYSA-N
Molecular Weight 169.286 g/mol
Number of Peaks 50
RI1 1209
RI2 919
SMILES c1(nc(sc1C)CC(C)C)C
SPLASH splash10-004i-5900000000-da46dbc14385f8a29857
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, 4,5-dimethyl-2-(2-methylpropyl)-
Wiley ID LM_FFNSC3_2014