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2,4-dimethyl-5-thiazolyl methyl ketone
SpectraBase Compound ID GDkNz2gfZxw
InChI InChI=1S/C7H9NOS/c1-4-7(5(2)9)10-6(3)8-4/h1-3H3
InChIKey BLQOKWQUTLNKON-UHFFFAOYSA-N
Mol Weight 155.21 g/mol
Molecular Formula C7H9NOS
Exact Mass 155.040485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qgtJypjiS
Name Thiazole<5-acetyl-2,4-dimethyl->
CAS Registry Number 38205-60-6
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 155.040485087 u
Formula C7H9NOS
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C7H9NOS/c1-4-7(5(2)9)10-6(3)8-4/h1-3H3
InChIKey BLQOKWQUTLNKON-UHFFFAOYSA-N
Molecular Weight 155.215 g/mol
Nominal Mass 155 u
Number of Peaks 70
SMILES c1(sc(nc1C)C)C(C)=O
SPLASH splash10-0006-9400000000-411408338b61c015cc06
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA002093