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(-)-4-[2-(Difluoromethoxy)phenyl]-2,6-dimethyl-1.4-dihydro-5-{[(pivaloyloxy)methoxy]carbonyl}-3-pyridinecarboxylic acid
SpectraBase Compound ID H1r4lA8DDfV
InChI InChI=1S/C22H25F2NO7/c1-11-15(18(26)27)17(13-8-6-7-9-14(13)32-21(23)24)16(12(2)25-11)19(28)30-10-31-20(29)22(3,4)5/h6-9,17,21,25H,10H2,1-5H3,(H,26,27)
InChIKey SYYWMTYJKNBTOU-UHFFFAOYSA-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 3dUMorxFOVL
Name (-)-4-[2-(Difluoromethoxy)phenyl]-2,6-dimethyl-1.4-dihydro-5-{[(pivaloyloxy)methoxy]carbonyl}-3-pyridinecarboxylic acid
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Formula C22H25F2NO7
InChI InChI=1S/C22H25F2NO7/c1-11-15(18(26)27)17(13-8-6-7-9-14(13)32-21(23)24)16(12(2)25-11)19(28)30-10-31-20(29)22(3,4)5/h6-9,17,21,25H,10H2,1-5H3,(H,26,27)
InChIKey SYYWMTYJKNBTOU-UHFFFAOYSA-N
Molecular Weight 453.439 g/mol
SMILES N1C(=C(C(C(C(=O)O)=C1C)c1c(cccc1)OC(F)F)C(=O)OCOC(C(C)(C)C)=O)C
SPLASH splash10-0gb9-0290000000-92eb99bca0beb49a55c6
Source of Spectrum QC-12-3254-4
Synonyms 4-[2-(difluoromethoxy)phenyl]-5-({[(2,2-dimethylpropanoyl)oxy]methoxy}carbonyl)-2,6-dimethyl-1,4-dihydro-3-pyridinecarboxylic acid
Wiley ID 1634857