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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hkXSeaZVMS
Name 1,3-Dioxolane, 4-[(heptyloxy)methyl]-2-phenyl-, (2R-cis)-
CAS Registry Number 61653-52-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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])(c1ccccc1)[H]
SPLASH splash10-052e-7920000000-7576473619a75a44377b
Source of Spectrum B-29-1767-0
Synonyms (2R,4S)-4-heptoxymethyl-2-phenyl-1,3-dioxolan (2R,4S)-4-heptoxymethyl-2-phenyl-1,3-dioxolane (2R,4S)-4-[(heptyloxy)methyl]-2-phenyl-1,3-dioxolane Heptyl[(2R,4S)-2-phenyl-1,3-dioxolan-4-yl]methyl ether
Wiley ID 1282263