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2-Pentanone, 3-chloro-3-fluoro-4-methyl-
SpectraBase Compound ID 9clSbuOWEmR
InChI InChI=1S/C6H10ClFO/c1-4(2)6(7,8)5(3)9/h4H,1-3H3
InChIKey FKUYNJGWXMXRBH-UHFFFAOYSA-N
Mol Weight 152.6 g/mol
Molecular Formula C6H10ClFO
Exact Mass 152.040421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jcqGBDMRWK
Name 2-Pentanone, 3-chloro-3-fluoro-4-methyl-
Alternate Name(s) 3-chloranyl-3-fluoranyl-4-methyl-pentan-2-one 3-Chloro-3-fluoro-4-methyl-2-pentanone 3-chloro-3-fluoro-4-methyl-pentan-2-one
CAS Registry Number 91524-37-7
Comments Less than 3 mono-isotopic peaks
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Formula C6H10ClFO
InChI InChI=1S/C6H10ClFO/c1-4(2)6(7,8)5(3)9/h4H,1-3H3
InChIKey FKUYNJGWXMXRBH-UHFFFAOYSA-N
Molecular Weight 152.596 g/mol
SMILES C(C(=O)C)(F)(Cl)C(C)C
SPLASH splash10-0006-9000000000-6c5e0f06aecd3d26a609
Source of Spectrum K-117-2204-0
Wiley ID 1148521