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2,4-Pentanedione, 3-(1-ethenylhexyl)-
SpectraBase Compound ID JluAN4C3GWb
InChI InChI=1S/C13H22O2/c1-5-7-8-9-12(6-2)13(10(3)14)11(4)15/h6,12-13H,2,5,7-9H2,1,3-4H3
InChIKey HUBVAGXCKSWASJ-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5F7FFoRZQVL
Name 2,4-Pentanedione, 3-(1-ethenylhexyl)-
Alternate Name(s) 3-(1-vinylhexyl)pentane-2,4-dione 3-Oct-1-en-3-ylpentane-2,4-dione
CAS Registry Number 80403-80-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-5-7-8-9-12(6-2)13(10(3)14)11(4)15/h6,12-13H,2,5,7-9H2,1,3-4H3
InChIKey HUBVAGXCKSWASJ-UHFFFAOYSA-N
Molecular Weight 210.317 g/mol
SMILES C(C(=O)C)(C(=O)C)C(C=C)CCCCC
SPLASH splash10-00kn-9800000000-11e06099bd22bd87947e
Source of Spectrum F-37-3014-0
Wiley ID 1209466