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Methyl 5-methyl-2-thienyl ketone
SpectraBase Compound ID BOkWAVGbvaj
InChI InChI=1S/C7H8OS/c1-5-3-4-7(9-5)6(2)8/h3-4H,1-2H3
InChIKey YOSDTJYMDAEEAZ-UHFFFAOYSA-N
Mol Weight 140.2 g/mol
Molecular Formula C7H8OS
Exact Mass 140.029586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZw43Kfqbid
Name Methyl 5-methyl-2-thienyl ketone
Source of Sample Penta Manifacturing Prod. code 01-09000
CAS Registry Number 13679-74-8
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 140.029586051 u
Formula C7H8OS
InChI InChI=1S/C7H8OS/c1-5-3-4-7(9-5)6(2)8/h3-4H,1-2H3
InChIKey YOSDTJYMDAEEAZ-UHFFFAOYSA-N
Molecular Weight 140.200 g/mol
Number of Peaks 50
RI1 1209
RI2 887
RI3 1255
RI4 1213
SMILES Cc1ccc(s1)C(=O)C
SPLASH splash10-004l-6900000000-ebd9c9794d20e83a636b
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 Ethanone, 1-(5-methyl-2-thienyl)-
Wiley ID LM_FFNSC3_2978