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Bis[(isobutyryloxy)methyl] 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1.4-dihydro-3,5-pyridinedicarboxylate
SpectraBase Compound ID 6ZCBwqOxM5R
InChI InChI=1S/C26H31F2NO9/c1-13(2)22(30)34-11-36-24(32)19-15(5)29-16(6)20(25(33)37-12-35-23(31)14(3)4)21(19)17-9-7-8-10-18(17)38-26(27)28/h7-10,13-14,21,26,29H,11-12H2,1-6H3
InChIKey PEIRNTDKOZNZQI-UHFFFAOYSA-N
Mol Weight 539.53 g/mol
Molecular Formula C26H31F2NO9
Exact Mass 539.196688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmYxigfCCXo
Name Bis[(isobutyryloxy)methyl] 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1.4-dihydro-3,5-pyridinedicarboxylate
Alternate Name(s) bis[(isobutyryloxy)methyl]4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31F2NO9
InChI InChI=1S/C26H31F2NO9/c1-13(2)22(30)34-11-36-24(32)19-15(5)29-16(6)20(25(33)37-12-35-23(31)14(3)4)21(19)17-9-7-8-10-18(17)38-26(27)28/h7-10,13-14,21,26,29H,11-12H2,1-6H3
InChIKey PEIRNTDKOZNZQI-UHFFFAOYSA-N
Molecular Weight 539.529 g/mol
SMILES N1C(=C(C(C(=C1C)C(=O)OCOC(=O)C(C)C)c1c(cccc1)OC(F)F)C(=O)OCOC(=O)C(C)C)C
SPLASH splash10-0002-1059210000-dc4114460c7822ec30c4
Source of Spectrum QC-12-3254-3
Wiley ID 1634858