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Ethanone, 1-[5-(1-hydroxy-2-methylpropyl)-2-thiazolyl]-
SpectraBase Compound ID BKhcwEXZKxo
InChI InChI=1S/C9H13NO2S/c1-5(2)8(12)7-4-10-9(13-7)6(3)11/h4-5,8,12H,1-3H3
InChIKey ZLCYOICMQKYNLU-UHFFFAOYSA-N
Mol Weight 199.27 g/mol
Molecular Formula C9H13NO2S
Exact Mass 199.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D5sNThcBdvK
Name Ethanone, 1-[5-(1-hydroxy-2-methylpropyl)-2-thiazolyl]-
Alternate Name(s) 1-[5-(1-hydroxy-2-methylpropyl)-1,3-thiazol-2-yl]ethanone 2-Acetyl-5-(1-hydroxy-2-methyl-propyl)-thiazole
CAS Registry Number 112970-13-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO2S
InChI InChI=1S/C9H13NO2S/c1-5(2)8(12)7-4-10-9(13-7)6(3)11/h4-5,8,12H,1-3H3
InChIKey ZLCYOICMQKYNLU-UHFFFAOYSA-N
Molecular Weight 199.268 g/mol
SMILES OC(c1sc(C(=O)C)nc1)C(C)C
SPLASH splash10-0a4i-1900000000-b2437854d2893d48cb29
Source of Spectrum J-53-1760-28
Wiley ID 1196547