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2,6-nonanedione 2-(2,2-dimethylpropylene ketal)
SpectraBase Compound ID 6erah8RKOYc
InChI InChI=1S/C14H26O3/c1-5-7-12(15)8-6-9-14(4)16-10-13(2,3)11-17-14/h5-11H2,1-4H3
InChIKey XOGMVGRXYIPXSO-UHFFFAOYSA-N
Mol Weight 242.36 g/mol
Molecular Formula C14H26O3
Exact Mass 242.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59YJoPqvn1l
Name 2,6-nonanedione 2-(2,2-dimethylpropylene ketal)
Alternate Name(s) 1-(2,5,5-trimethyl-1,3-dioxan-2-yl)-4-heptanone
CAS Registry Number 109531-97-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O3
InChI InChI=1S/C14H26O3/c1-5-7-12(15)8-6-9-14(4)16-10-13(2,3)11-17-14/h5-11H2,1-4H3
InChIKey XOGMVGRXYIPXSO-UHFFFAOYSA-N
Molecular Weight 242.359 g/mol
SMILES C1(OCC(CO1)(C)C)(CCCC(=O)CCC)C
SPLASH splash10-004i-1910000000-87ce8bba069553f763b1
Source of Spectrum J-52-4277-3
Wiley ID 1245190