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2-Methyl-2-propylvaleriansaeure

View entire compound with spectra: 11 NMR, 1 FTIR, and 2 MS (GC)

2-Methyl-2-propylvaleriansaeure
SpectraBase Compound ID 1myxHjLcJOY
InChI InChI=1S/C9H18O2/c1-4-6-9(3,7-5-2)8(10)11/h4-7H2,1-3H3,(H,10,11)
InChIKey KTHXOYWHJBTQNC-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 Ad3HAj6J7u
Name 2-Propyl-2-methyl-pentanoic acid
CAS Registry Number 31113-56-1
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-4-6-9(3,7-5-2)8(10)11/h4-7H2,1-3H3,(H,10,11)
InChIKey KTHXOYWHJBTQNC-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference P.A. Couperus, A.D. Clague, Org. Magn. Resonance 11, 590 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3