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6-Acetoxy-3-(2',3',4'-trimethoxyphenyl)cyclohex-2-en-1-one
SpectraBase Compound ID BAqgCEJsabZ
InChI InChI=1S/C17H20O6/c1-10(18)23-14-7-5-11(9-13(14)19)12-6-8-15(20-2)17(22-4)16(12)21-3/h6,8-9,14H,5,7H2,1-4H3
InChIKey DDXGEBSBZLDIEG-UHFFFAOYSA-N
Mol Weight 320.34 g/mol
Molecular Formula C17H20O6
Exact Mass 320.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3rnDLeIhexu
Name 6-Acetoxy-3-(2',3',4'-trimethoxyphenyl)cyclohex-2-en-1-one
Alternate Name(s) 2-Oxo-4-(2,3,4-trimethoxyphenyl)-3-cyclohexen-1-yl acetate
CAS Registry Number 116211-58-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O6
InChI InChI=1S/C17H20O6/c1-10(18)23-14-7-5-11(9-13(14)19)12-6-8-15(20-2)17(22-4)16(12)21-3/h6,8-9,14H,5,7H2,1-4H3
InChIKey DDXGEBSBZLDIEG-UHFFFAOYSA-N
Molecular Weight 320.341 g/mol
SMILES C1(c2c(c(OC)c(cc2)OC)OC)=CC(=O)C(CC1)OC(=O)C
SPLASH splash10-02t9-0092000000-b4796499be1d874303dc
Source of Spectrum J-53-4949-11
Wiley ID 1320018