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3-[2-(3,4-Dichlorobenzoyl)allyl]-4-hydroxy-6-methylpyran-2-one
SpectraBase Compound ID 2zkELBDvzTy
InChI InChI=1S/C16H12Cl2O4/c1-8(5-11-14(19)6-9(2)22-16(11)21)15(20)10-3-4-12(17)13(18)7-10/h3-4,6-7,19H,1,5H2,2H3
InChIKey JCXCXRHDTPVKCU-UHFFFAOYSA-N
Mol Weight 339.17 g/mol
Molecular Formula C16H12Cl2O4
Exact Mass 338.011264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BCVvNrcGAjL
Name 3-[2-(3,4-Dichlorobenzoyl)allyl]-4-hydroxy-6-methylpyran-2-one
Alternate Name(s) 3-[2-(3,4-dichlorobenzoyl)-2-propenyl]-4-hydroxy-6-methyl-2H-pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12Cl2O4
InChI InChI=1S/C16H12Cl2O4/c1-8(5-11-14(19)6-9(2)22-16(11)21)15(20)10-3-4-12(17)13(18)7-10/h3-4,6-7,19H,1,5H2,2H3
InChIKey JCXCXRHDTPVKCU-UHFFFAOYSA-N
Molecular Weight 339.174 g/mol
SMILES OC1=C(C(OC(=C1)C)=O)CC(C(c1cc(Cl)c(cc1)Cl)=O)=C
SPLASH splash10-014i-3900000000-188938e6957c8060cbce
Source of Spectrum H1-53-2430-7
Wiley ID 818095