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

View entire compound with spectra: 5 NMR, 4 FTIR, and 2 MS (GC)

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) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LFFIkzLyq9e
Name 1-Chloropinacolone
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 348139
CAS Registry Number 13547-70-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 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
Observed nucleus 13C
Purity 95%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1-Chloro-3,3-dimethyl-2-butanone
Wiley ID SIAL_13CNMR_007294