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1-Chloro-3,3-dimethyl-2-butanone

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1-Chloro-3,3-dimethyl-2-butanone
SpectraBase Compound ID LB1Sh1XmS8I
InChI InChI=1S/C6H11ClO/c1-6(2,3)5(8)4-7/h4H2,1-3H3
InChIKey ULSAJQMHTGKPIY-UHFFFAOYSA-N
Mol Weight 134.61 g/mol
Molecular Formula C6H11ClO
Exact Mass 134.049843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G5DdLhtrdIu
Name 1-CHLORO-3,3-DIMETHYL-2-BUTANONE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Boiling Point 173C
CAS Registry Number 13547-70-1
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11ClO
InChI InChI=1S/C6H11ClO/c1-6(2,3)5(8)4-7/h4H2,1-3H3
InChIKey ULSAJQMHTGKPIY-UHFFFAOYSA-N
Molecular Weight 134.61
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms PINACOLIN, 1-CHLORO-, 2-BUTANONE, 1-CHLORO-3,3-DIMETHYL-,