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methyl 2,6-dideuteriopyridine-3-carboxylate
SpectraBase Compound ID 940SSITl1Fr
InChI InChI=1S/C7H7NO2/c1-10-7(9)6-3-2-4-8-5-6/h2-5H,1H3/i4D,5D
InChIKey YNBADRVTZLEFNH-KFRNQKGQSA-N
Mol Weight 139.15 g/mol
Molecular Formula C7H5D2NO2
Exact Mass 139.060232 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7soMdNBplJc
Name methyl 2,6-dideuteriopyridine-3-carboxylate
Alternate Name(s) 2,6-dideuterio-3-pyridinecarboxylic acid methyl ester 2,6-dideuterionicotinic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C7H5D2NO2
InChI InChI=1S/C7H7NO2/c1-10-7(9)6-3-2-4-8-5-6/h2-5H,1H3/i4D,5D
InChIKey YNBADRVTZLEFNH-KFRNQKGQSA-N
Molecular Weight 139.150 g/mol
SMILES C(c1c(nc(cc1)[D])[D])(=O)OC
SPLASH splash10-052r-0900000000-b846a77a3e2455be5de9
Source of Spectrum AJ-42-75-3
Wiley ID 1567723