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3,3-dichloropentan-2-one
SpectraBase Compound ID 4XrvJMlAdPB
InChI InChI=1S/C5H8Cl2O/c1-3-5(6,7)4(2)8/h3H2,1-2H3
InChIKey VKWUGBQFNMLUAO-UHFFFAOYSA-N
Mol Weight 155.02 g/mol
Molecular Formula C5H8Cl2O
Exact Mass 153.99522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J0nWxYOwgAb
Name 2-Pentanone, 3,3-dichloro-
CAS Registry Number 57856-10-7
Comments Less than 3 mono-isotopic peaks
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Formula C5H8Cl2O
InChI InChI=1S/C5H8Cl2O/c1-3-5(6,7)4(2)8/h3H2,1-2H3
InChIKey VKWUGBQFNMLUAO-UHFFFAOYSA-N
Molecular Weight 155.024 g/mol
SMILES C(C(=O)C)(Cl)(Cl)CC
SPLASH splash10-0006-9000000000-5266d1ca1ff62b9f8640
Source of Spectrum K-114-1869-0
Synonyms 3,3-bis(chloranyl)pentan-2-one 3,3-Dichloro-2-pentanone 3,3-dichloropentan-2-one
Wiley ID 1150723