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1,1-Dichloro-3-methyl-3-(2-thiazolyl)-2-butanone
SpectraBase Compound ID 2e8Q2CzTVck
InChI InChI=1S/C8H9Cl2NOS/c1-8(2,5(12)6(9)10)7-11-3-4-13-7/h3-4,6H,1-2H3
InChIKey PXQKUUQDIITYCT-UHFFFAOYSA-N
Mol Weight 238.13 g/mol
Molecular Formula C8H9Cl2NOS
Exact Mass 236.97819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuqE6M8c9KA
Name 1,1-Dichloro-3-methyl-3-(2-thiazolyl)-2-butanone
CAS Registry Number 87830-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9Cl2NOS
InChI InChI=1S/C8H9Cl2NOS/c1-8(2,5(12)6(9)10)7-11-3-4-13-7/h3-4,6H,1-2H3
InChIKey PXQKUUQDIITYCT-UHFFFAOYSA-N
Molecular Weight 238.132 g/mol
SMILES C(c1nccs1)(C(C(Cl)Cl)=O)(C)C
SPLASH splash10-056r-4900000000-c71d5d22cf1f1ef0394b
Source of Spectrum J-49-595-0
Synonyms 1,1-bis(chloranyl)-3-methyl-3-(1,3-thiazol-2-yl)butan-2-one 1,1-Dichloro-3-methyl-3-(1,3-thiazol-2-yl)butan-2-one 1,1-Dichloro-3-methyl-3-thiazol-2-yl-butan-2-one
Wiley ID 1239263