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3-Hexanone, 2,2,5,5-tetramethyl-4-[(3,4,5-trimethoxyphenyl)methyl]-
SpectraBase Compound ID 5GZVoT6QNLI
InChI InChI=1S/C20H32O4/c1-19(2,3)14(18(21)20(4,5)6)10-13-11-15(22-7)17(24-9)16(12-13)23-8/h11-12,14H,10H2,1-9H3
InChIKey NKRPPCPWKCZFGF-UHFFFAOYSA-N
Mol Weight 336.5 g/mol
Molecular Formula C20H32O4
Exact Mass 336.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9fbZshSmYHv
Name 3-Hexanone, 2,2,5,5-tetramethyl-4-[(3,4,5-trimethoxyphenyl)methyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.230059506 u
Formula C20H32O4
InChI InChI=1S/C20H32O4/c1-19(2,3)14(18(21)20(4,5)6)10-13-11-15(22-7)17(24-9)16(12-13)23-8/h11-12,14H,10H2,1-9H3
InChIKey NKRPPCPWKCZFGF-UHFFFAOYSA-N
Molecular Weight 336.472 g/mol
SMILES C(C(C(C)(C)C)CC=1C=C(OC)C(=C(C1)OC)OC)(C(C)(C)C)=O