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2-Ethylbutyric acid, 2-hexyl ester
SpectraBase Compound ID E7B6iPmTQ7P
InChI InChI=1S/C12H24O2/c1-5-8-9-10(4)14-12(13)11(6-2)7-3/h10-11H,5-9H2,1-4H3
InChIKey RUOFSODBNPOILK-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DrHrAcuft4n
Name 2-Ethylbutyric acid, 2-hexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 200.177630011 u
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-5-8-9-10(4)14-12(13)11(6-2)7-3/h10-11H,5-9H2,1-4H3
InChIKey RUOFSODBNPOILK-UHFFFAOYSA-N
Molecular Weight 200.322 g/mol
SMILES C(C(OC(C)CCCC)=O)(CC)CC