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(2-methyl-3-oxidanylidene-nonan-4-yl) ethanoate
SpectraBase Compound ID IWNCTI5fN3z
InChI InChI=1S/C12H22O3/c1-5-6-7-8-11(15-10(4)13)12(14)9(2)3/h9,11H,5-8H2,1-4H3
InChIKey ZZYKDCJFUFZATF-UHFFFAOYSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JW6yztrEmg5
Name (2-methyl-3-oxidanylidene-nonan-4-yl) ethanoate
CAS Registry Number 105824-01-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-5-6-7-8-11(15-10(4)13)12(14)9(2)3/h9,11H,5-8H2,1-4H3
InChIKey ZZYKDCJFUFZATF-UHFFFAOYSA-N
Molecular Weight 214.305 g/mol
SMILES C(C(OC(=O)C)CCCCC)(=O)C(C)C
SPLASH splash10-0006-9000000000-21c8b9559d66ee20c159
Source of Spectrum AJ-59-948-2
Synonyms (2-methyl-3-oxononan-4-yl) acetate 1-(2-Methylpropanoyl)hexyl acetate Acetic acid (2-methyl-3-oxononan-4-yl) ester Acetic acid 1-isobutyrylhexyl ester
Wiley ID 1213630