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2,4-Dimethyl-heptanoic acid
SpectraBase Compound ID 1xZzVUp6h3L
InChI InChI=1S/C9H18O2/c1-4-5-7(2)6-8(3)9(10)11/h7-8H,4-6H2,1-3H3,(H,10,11)
InChIKey PLTFCXPZUBKUMW-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID WaLcUxAwkM
Name 2,4-Dimethyl-heptanoic acid
CAS Registry Number 2624-25-1
Comments LOW FIELD LINES OF DIASTEREOMERS D.H.MARR,ORG.MAGN.RESONANCE 13,2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-4-5-7(2)6-8(3)9(10)11/h7-8H,4-6H2,1-3H3,(H,10,11)
InChIKey PLTFCXPZUBKUMW-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference A.B. Terentev, V.I. Dostalova, Org. Magn. Resonance 9, 301 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4