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1,3-Dioxolane, 4-[(heptyloxy)methyl]-2-phenyl-, (2R-cis)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1,3-Dioxolane, 4-[(heptyloxy)methyl]-2-phenyl-, (2R-cis)-
SpectraBase Compound ID 1aaTWQY4UM0
InChI InChI=1S/C17H26O3/c1-2-3-4-5-9-12-18-13-16-14-19-17(20-16)15-10-7-6-8-11-15/h6-8,10-11,16-17H,2-5,9,12-14H2,1H3/t16-,17+/m0/s1
InChIKey DRSHMZOJHXYHSJ-DLBZAZTESA-N
Mol Weight 278.39 g/mol
Molecular Formula C17H26O3
Exact Mass 278.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AG6tTTW0Lb7
Name 1,3-Dioxolane, 4-[(heptyloxy)methyl]-2-phenyl-, (2R-cis)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.188194694 u
Formula C17H26O3
InChI InChI=1S/C17H26O3/c1-2-3-4-5-9-12-18-13-16-14-19-17(20-16)15-10-7-6-8-11-15/h6-8,10-11,16-17H,2-5,9,12-14H2,1H3/t16-,17+/m0/s1
InChIKey DRSHMZOJHXYHSJ-DLBZAZTESA-N
Molecular Weight 278.392 g/mol
SMILES [C@]1(O[C@@](COCCCCCCC)(CO1)[H])(C=1C=CC=CC1)[H]