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(4R)-4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(isobutyryloxymethyl) ester O3-methyl ester
SpectraBase Compound ID 6B1SEkgyswM
InChI InChI=1S/C22H25F2NO7/c1-11(2)19(26)30-10-31-21(28)17-13(4)25-12(3)16(20(27)29-5)18(17)14-8-6-7-9-15(14)32-22(23)24/h6-9,11,18,22,25H,10H2,1-5H3/t18-/m1/s1
InChIKey XYUBWRNYQQJBNP-GOSISDBHSA-N
Mol Weight 453.44 g/mol
Molecular Formula C22H25F2NO7
Exact Mass 453.159908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GpIa3vyQM
Name (4R)-4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-(isobutyryloxymethyl) ester O3-methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25F2NO7
InChI InChI=1S/C22H25F2NO7/c1-11(2)19(26)30-10-31-21(28)17-13(4)25-12(3)16(20(27)29-5)18(17)14-8-6-7-9-15(14)32-22(23)24/h6-9,11,18,22,25H,10H2,1-5H3/t18-/m1/s1
InChIKey XYUBWRNYQQJBNP-GOSISDBHSA-N
Molecular Weight 453.439 g/mol
SMILES N1C(=C([C@@](C(=C1C)C(=O)OC)(c1c(OC(F)F)cccc1)[H])C(OCOC(=O)C(C)C)=O)C
SPLASH splash10-03di-1089000000-98ac1ff1b62c11f27fb4
Source of Spectrum QC-12-3255-5
Synonyms 3-O-methyl 5-O-(2-methylpropanoyloxymethyl) (4R)-4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate O3-methyl O5-(2-methylpropanoyloxymethyl) (4R)-4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate O3-methyl O5-(2-methylpropanoyloxymethyl) (4R)-4-[2-[bis(fluoranyl)methoxy]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Wiley ID 1634855