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2,6-Dimethyl-4-heptanone

View entire compound with spectra: 18 NMR, 15 FTIR, 1 Raman, 18 MS (GC), and 2 Near IR

2,6-Dimethyl-4-heptanone
SpectraBase Compound ID 5jn2OmKSw7W
InChI InChI=1S/C9H18O/c1-7(2)5-9(10)6-8(3)4/h7-8H,5-6H2,1-4H3
InChIKey PTTPXKJBFFKCEK-UHFFFAOYSA-N
Mol Weight 142.24 g/mol
Molecular Formula C9H18O
Exact Mass 142.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B7shkdCTaIN
Name 2,6-Dimethyl-4-heptanone
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number W353701
CAS Registry Number 108-83-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O
InChI InChI=1S/C9H18O/c1-7(2)5-9(10)6-8(3)4/h7-8H,5-6H2,1-4H3
InChIKey PTTPXKJBFFKCEK-UHFFFAOYSA-N
Observed nucleus 13C
Purity >=99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Diisobutyl ketone Isovalerone
Wiley ID SIAL_13CNMR_013209