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1-(4-Methoxyphenyl)-1,4-pentandione
SpectraBase Compound ID FSNrJwnorXD
InChI InChI=1S/C12H14O3/c1-9(13)3-8-12(14)10-4-6-11(15-2)7-5-10/h4-7H,3,8H2,1-2H3
InChIKey CVFRDQUUQZKDMJ-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sHUQbE8GHF
Name 1-(4-Methoxyphenyl)-1,4-pentandione
Alternate Name(s) 1-(4-Methoxyphenyl)pentane-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-9(13)3-8-12(14)10-4-6-11(15-2)7-5-10/h4-7H,3,8H2,1-2H3
InChIKey CVFRDQUUQZKDMJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19741070510
Molecular Weight 206.241 g/mol
SMILES C(CCC(C)=O)(=O)c1ccc(cc1)OC
SPLASH splash10-000l-7910000000-30a3d5eab4f7094f3a4f
Source of Spectrum K-107-1508-12j
Wiley ID 1793646