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(-)-4(R)-4-[2-(Difluoromethoxy)phenyl]-2,6-dimethyl-1.4-dihydro-5-{[(isobutyryloxy)methoxy]carbonyl}-3-pyridinecarboxylic acid
SpectraBase Compound ID GXimf9Staqh
InChI InChI=1S/C21H23F2NO7/c1-10(2)19(27)29-9-30-20(28)16-12(4)24-11(3)15(18(25)26)17(16)13-7-5-6-8-14(13)31-21(22)23/h5-8,10,17,21,24H,9H2,1-4H3,(H,25,26)/t17-/m1/s1
InChIKey PDPIKDLEMYOFEZ-QGZVFWFLSA-N
Mol Weight 439.41 g/mol
Molecular Formula C21H23F2NO7
Exact Mass 439.144258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1w0zgAZ58Io
Name (-)-4(R)-4-[2-(Difluoromethoxy)phenyl]-2,6-dimethyl-1.4-dihydro-5-{[(isobutyryloxy)methoxy]carbonyl}-3-pyridinecarboxylic acid
Alternate Name(s) (4R)-4-[2-(difluoromethoxy)phenyl]-5-{[(isobutyryloxy)methoxy]carbonyl}-2,6-dimethyl-1,4-dihydro-3-pyridinecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23F2NO7
InChI InChI=1S/C21H23F2NO7/c1-10(2)19(27)29-9-30-20(28)16-12(4)24-11(3)15(18(25)26)17(16)13-7-5-6-8-14(13)31-21(22)23/h5-8,10,17,21,24H,9H2,1-4H3,(H,25,26)/t17-/m1/s1
InChIKey PDPIKDLEMYOFEZ-QGZVFWFLSA-N
Molecular Weight 439.412 g/mol
SMILES OC(C1=C(NC(=C([C@@]1(c1c(OC(F)F)cccc1)[H])C(OCOC(=O)C(C)C)=O)C)C)=O
SPLASH splash10-0udi-1791000000-854ce3e14b12113e9ffd
Source of Spectrum QC-12-3255-4
Wiley ID 1634856