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1,2-Benzenedicarboxylic acid, mono(tetrahydro-4,4,5,5-tetramethyl-2-oxo-3-phenyl-3-furanyl) ester, (.+-.)-
SpectraBase Compound ID I9Esezk11nI
InChI InChI=1S/C22H22O6/c1-20(2)21(3,4)28-19(26)22(20,14-10-6-5-7-11-14)27-18(25)16-13-9-8-12-15(16)17(23)24/h5-13H,1-4H3,(H,23,24)
InChIKey IGUMVXYDHWSMLI-UHFFFAOYSA-N
Mol Weight 382.41 g/mol
Molecular Formula C22H22O6
Exact Mass 382.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID UqXB5lBNw2
Name 1,2-Benzenedicarboxylic acid, mono(tetrahydro-4,4,5,5-tetramethyl-2-oxo-3-phenyl-3-furanyl) ester, (.+-.)-
Alternate Name(s) 2-{[(4,4,5,5-tetramethyl-2-oxo-3-phenyltetrahydro-3-furanyl)oxy]carbonyl}benzoic acid rac-tetrahydro-4,4,5,5-tetramethyl-2-oxo-3-phenylfur-3-yl 2-oxo-2-phenyl-hydrogen benzene-1,2-dicarboxylate
CAS Registry Number 128643-72-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O6
InChI InChI=1S/C22H22O6/c1-20(2)21(3,4)28-19(26)22(20,14-10-6-5-7-11-14)27-18(25)16-13-9-8-12-15(16)17(23)24/h5-13H,1-4H3,(H,23,24)
InChIKey IGUMVXYDHWSMLI-UHFFFAOYSA-N
Molecular Weight 382.412 g/mol
SMILES OC(c1c(C(OC2(C(OC(C2(C)C)(C)C)=O)c2ccccc2)=O)cccc1)=O
SPLASH splash10-0a4l-8900000000-872d519912b3587fcadf
Source of Spectrum H-72-1799-9
Wiley ID 1360603