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1-Tetraloyl pivalate
SpectraBase Compound ID 83pSx64Rb8u
InChI InChI=1S/C15H20O2/c1-15(2,3)14(16)17-13-10-6-8-11-7-4-5-9-12(11)13/h4-5,7,9,13H,6,8,10H2,1-3H3
InChIKey SAQHTGLQVFAJLL-UHFFFAOYSA-N
Mol Weight 232.32 g/mol
Molecular Formula C15H20O2
Exact Mass 232.14633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2HDQdppMICh
Name 1-Tetraloyl pivalate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.146329882 u
Formula C15H20O2
InChI InChI=1S/C15H20O2/c1-15(2,3)14(16)17-13-10-6-8-11-7-4-5-9-12(11)13/h4-5,7,9,13H,6,8,10H2,1-3H3
InChIKey SAQHTGLQVFAJLL-UHFFFAOYSA-N
Molecular Weight 232.323 g/mol
SMILES C(OC1C2=C(C=CC=C2)CCC1)(C(C)(C)C)=O