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4-Methyl-2-pentanone

View entire compound with spectra: 39 NMR, 24 FTIR, 2 Raman, 36 MS (GC), and 2 Near IR

4-Methyl-2-pentanone
SpectraBase Compound ID 99jAXE64w6k
InChI InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3
InChIKey NTIZESTWPVYFNL-UHFFFAOYSA-N
Mol Weight 100.16 g/mol
Molecular Formula C6H12O
Exact Mass 100.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IRC060TSWDk
Name 4-Methyl-2-pentanone
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 242896
CAS Registry Number 108-10-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O
InChI InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3
InChIKey NTIZESTWPVYFNL-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99+%, Spectrophotometric grade
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_004010