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(E)-5-isopropylnon-3-ene-2,8-dione
SpectraBase Compound ID EDSVrdEwVcF
InChI InChI=1S/C12H20O2/c1-9(2)12(7-5-10(3)13)8-6-11(4)14/h5,7,9,12H,6,8H2,1-4H3/b7-5+
InChIKey LMQNNMSEZLHCKT-FNORWQNLSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HleJxjp1rFd
Name (E)-5-isopropylnon-3-ene-2,8-dione
Alternate Name(s) (E)-5-propan-2-yl-3-nonene-2,8-dione (E)-5-propan-2-ylnon-3-ene-2,8-dione
CAS Registry Number 58001-08-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-9(2)12(7-5-10(3)13)8-6-11(4)14/h5,7,9,12H,6,8H2,1-4H3/b7-5+
InChIKey LMQNNMSEZLHCKT-FNORWQNLSA-N
Molecular Weight 196.290 g/mol
SMILES C(\C=C\C(CCC(=O)C)C(C)C)(=O)C
SPLASH splash10-0006-9200000000-3e925ee905f191f75dec
Source of Spectrum J-55-516-14
Wiley ID 1193625