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JY7SnrRXcXx
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JY7SnrRXcXx
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Methyl 8-(5,5,7,7-tetramethyl-2,6-dioxabicyclo[2.2.2]octan-3-yl)octanoate
SpectraBase Compound ID AZY2xMpjIxD
InChI InChI=1S/C19H34O4/c1-18(2)13-14-15(22-17(18)23-19(14,3)4)11-9-7-6-8-10-12-16(20)21-5/h14-15,17H,6-13H2,1-5H3/t14-,15+,17+/m1/s1
InChIKey HEVARWHXKLMPTJ-VYDXJSESSA-N
Mol Weight 326.5 g/mol
Molecular Formula C19H34O4
Exact Mass 326.24571 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JY7SnrRXcXx
Name Methyl 8-(5,5,7,7-tetramethyl-2,6-dioxabicyclo[2.2.2]octan-3-yl)octanoate
Appearance Colorless oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.245709571 u
Formula C19H34O4
GC Column HP-5 MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C19H34O4/c1-18(2)13-14-15(22-17(18)23-19(14,3)4)11-9-7-6-8-10-12-16(20)21-5/h14-15,17H,6-13H2,1-5H3/t14-,15+,17+/m1/s1
InChIKey HEVARWHXKLMPTJ-VYDXJSESSA-N
Instrument Name Agilent 6890 N-5975
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600847
Molecular Weight 326.477 g/mol
Quality 109
Reported Formula C19H34O4
SMILES [C@]12(O[C@]([C@](C(O2)(C)C)(CC1(C)C)[H])(CCCCCCCC(OC)=O)[H])[H]
SPLASH splash10-00dr-5190000000-8a90bd864937a95c786e
Source of Spectrum QE-22-SM9-7h (DOI: 10.1002/chem.201600847)
Wiley ID 1903186
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