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1,1'-(4,6-bis(3-Methylbutyl)oxy-1,3-phenylene)bisethanone
SpectraBase Compound ID 2RvB7o29az6
InChI InChI=1S/C20H30O4/c1-13(2)7-9-23-19-12-20(24-10-8-14(3)4)18(16(6)22)11-17(19)15(5)21/h11-14H,7-10H2,1-6H3
InChIKey WXBSJTMPHKUSLQ-UHFFFAOYSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JylV68Y0c4I
Name 1,1'-(4,6-bis(3-Methylbutyl)oxy-1,3-phenylene)bisethanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.214409442 u
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-13(2)7-9-23-19-12-20(24-10-8-14(3)4)18(16(6)22)11-17(19)15(5)21/h11-14H,7-10H2,1-6H3
InChIKey WXBSJTMPHKUSLQ-UHFFFAOYSA-N
Molecular Weight 334.456 g/mol
SMILES C1(=CC(OCCC(C)C)=C(C=C1C(C)=O)C(=O)C)OCCC(C)C