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3,5-Dimethyl-4-heptanone
SpectraBase Compound ID 8OD6CcK8Dhj
InChI InChI=1S/C9H18O/c1-5-7(3)9(10)8(4)6-2/h7-8H,5-6H2,1-4H3
InChIKey VZXXYILNWWRSGE-UHFFFAOYSA-N
Mol Weight 142.24 g/mol
Molecular Formula C9H18O
Exact Mass 142.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H0x5RlzkUcb
Name 3,5-Dimethyl-4-heptanone
CAS Registry Number 19549-84-9
Comments LOWFIELD DIASTEREOMER SHIFT REGISTERED FOR C4 (206.3 PPM) MUST BE WRONG
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Formula C9H18O
InChI InChI=1S/C9H18O/c1-5-7(3)9(10)8(4)6-2/h7-8H,5-6H2,1-4H3
InChIKey VZXXYILNWWRSGE-UHFFFAOYSA-N
Instrument Name Varian CFT-20
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3