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4,5-Dimethyl-2-isobutyl-3-thiazoline
SpectraBase Compound ID EHmXSVPrcI1
InChI InChI=1S/C9H17NS/c1-6(2)5-9-10-7(3)8(4)11-9/h6,8-9H,5H2,1-4H3
InChIKey FDOISHJOXPONIV-UHFFFAOYSA-N
Mol Weight 171.3 g/mol
Molecular Formula C9H17NS
Exact Mass 171.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F70JLnakBME
Name Thiazoline <4,5-Dimethyl-2-isobutyl-3-> (isomer I)
Source of Sample SAFC Cat.no. W362107
CAS Registry Number 65894-83-9
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 171.108170725 u
Formula C9H17NS
InChI InChI=1S/C9H17NS/c1-6(2)5-9-10-7(3)8(4)11-9/h6,8-9H,5H2,1-4H3
InChIKey FDOISHJOXPONIV-UHFFFAOYSA-N
Molecular Weight 171.302 g/mol
Number of Peaks 50
RI1 1234
RI2 913
SMILES C1(N=C(C(S1)C)C)CC(C)C
SPLASH splash10-044u-9600000000-9f11805c7538d67e91d5
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, 2,5-dihydro-4,5-dimethyl-2-(2-methylpropyl)-
Wiley ID LM_FFNSC3_2012