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1-(2,5-Dimethoxyphenyl)-1,3-butanedione
SpectraBase Compound ID Jy7P5TluJcU
InChI InChI=1S/C12H14O4/c1-8(13)6-11(14)10-7-9(15-2)4-5-12(10)16-3/h4-5,7H,6H2,1-3H3
InChIKey IWGWZCMYHSKSRE-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Nts660pVI
Name 1-(2,5-Dimethoxyphenyl)-1,3-butanedione
Alternate Name(s) 1,3-Butanedione, 1-(2,5-dimethoxyphenyl)- 1-(2,5-dimethoxyphenyl)butane-1,3-dione
CAS Registry Number 65547-50-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-8(13)6-11(14)10-7-9(15-2)4-5-12(10)16-3/h4-5,7H,6H2,1-3H3
InChIKey IWGWZCMYHSKSRE-UHFFFAOYSA-N
Molecular Weight 222.240 g/mol
SMILES c1c(c(cc(c1)OC)C(=O)CC(C)=O)OC
SPLASH splash10-00kf-4910000000-6a82fb229d039eacb0b1
Wiley ID 1489468