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2,6-Pyridinedicarboxylic acid, 2,2,3,3,4,4,4-heptafluorobutyl 4-methylpent-2-yl ester
SpectraBase Compound ID DEOpEjQ96ut
InChI InChI=1S/C17H18F7NO4/c1-9(2)7-10(3)29-14(27)12-6-4-5-11(25-12)13(26)28-8-15(18,19)16(20,21)17(22,23)24/h4-6,9-10H,7-8H2,1-3H3
InChIKey ANCCKKMNLKVOGY-UHFFFAOYSA-N
Mol Weight 433.32 g/mol
Molecular Formula C17H18F7NO4
Exact Mass 433.112405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwRehDtSZfG
Name 2,6-Pyridinedicarboxylic acid, 2,2,3,3,4,4,4-heptafluorobutyl 4-methylpent-2-yl ester
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Formula C17H18F7NO4
InChI InChI=1S/C17H18F7NO4/c1-9(2)7-10(3)29-14(27)12-6-4-5-11(25-12)13(26)28-8-15(18,19)16(20,21)17(22,23)24/h4-6,9-10H,7-8H2,1-3H3
InChIKey ANCCKKMNLKVOGY-UHFFFAOYSA-N
Molecular Weight 433.323 g/mol
SMILES C(OC(c1nc(ccc1)C(OCC(C(C(F)(F)F)(F)F)(F)F)=O)=O)(C)CC(C)C
SPLASH splash10-0uec-9207000000-8800d0b47df6be4cc679
Source of Spectrum TIPS-2023-1004-0
Wiley ID 1885710