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2-Butanone, 1,1,3(or 1,1,4)-trichloro-
SpectraBase Compound ID DzsbJmaQqzS
InChI InChI=1S/C4H5Cl3O/c5-2-1-3(8)4(6)7/h4H,1-2H2
InChIKey IIISEIUJPZRKTD-UHFFFAOYSA-N
Mol Weight 175.44 g/mol
Molecular Formula C4H5Cl3O
Exact Mass 173.940598 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LC3l3zBbIZv
Name 2-Butanone, 1,1,3(or 1,1,4)-trichloro-
Alternate Name(s) 1,1,4- and/or 1,1,3-trichloro-2-butanone 1,1,4-trichloro-2-butanone 1,1,4-trichlorobutan-2-one
CAS Registry Number 56272-98-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5Cl3O
InChI InChI=1S/C4H5Cl3O/c5-2-1-3(8)4(6)7/h4H,1-2H2
InChIKey IIISEIUJPZRKTD-UHFFFAOYSA-N
Molecular Weight 175.442 g/mol
SMILES C(C(Cl)Cl)(=O)CCCl
SPLASH splash10-000i-3900000000-4839aacbb9e3e6b81032
Source of Spectrum JX-2015-6-9010
Wiley ID 1730128