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Dodecanoic acid, 3-methylbut-2-yl ester
SpectraBase Compound ID 9LGXRHwNDIL
InChI InChI=1S/C17H34O2/c1-5-6-7-8-9-10-11-12-13-14-17(18)19-16(4)15(2)3/h15-16H,5-14H2,1-4H3
InChIKey BPATUEDDMFPLJI-UHFFFAOYSA-N
Mol Weight 270.5 g/mol
Molecular Formula C17H34O2
Exact Mass 270.25588 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FBMj3qXYSQZ
Name Dodecanoic acid, 3-methylbut-2-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.255880333 u
Formula C17H34O2
InChI InChI=1S/C17H34O2/c1-5-6-7-8-9-10-11-12-13-14-17(18)19-16(4)15(2)3/h15-16H,5-14H2,1-4H3
InChIKey BPATUEDDMFPLJI-UHFFFAOYSA-N
Molecular Weight 270.457 g/mol
SMILES CCCCCCCCCCCC(=O)OC(C(C)C)C