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1,3-Dioxolane, 2,2-dimethyl-4-[[(2-propoxy-4-hexadecynyl)oxy]methyl]-
SpectraBase Compound ID KEGlLMEEwaq
InChI InChI=1S/C25H46O4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-23(27-19-6-2)20-26-21-24-22-28-25(3,4)29-24/h23-24H,5-15,18-22H2,1-4H3
InChIKey SZTCRZTVMSMONE-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H46O4
Exact Mass 410.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AhJ5oVWREmJ
Name 1,3-Dioxolane, 2,2-dimethyl-4-[[(2-propoxy-4-hexadecynyl)oxy]methyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.339609957 u
Formula C25H46O4
InChI InChI=1S/C25H46O4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-23(27-19-6-2)20-26-21-24-22-28-25(3,4)29-24/h23-24H,5-15,18-22H2,1-4H3
InChIKey SZTCRZTVMSMONE-UHFFFAOYSA-N
Molecular Weight 410.639 g/mol
SMILES C1(OC(COCC(CC#CCCCCCCCCCCC)OCCC)CO1)(C)C