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1-tert-Butyl-2-keto-6-methyl-pyridine-3,4,5-tricarboxylic acid O3,O4-ditert-butyl ester O5-methyl ester
SpectraBase Compound ID FjiKvjKUtvZ
InChI InChI=1S/C22H33NO7/c1-12-13(17(25)28-11)14(18(26)29-21(5,6)7)15(19(27)30-22(8,9)10)16(24)23(12)20(2,3)4/h1-11H3
InChIKey NXODPEUPLZVIFM-UHFFFAOYSA-N
Mol Weight 423.5 g/mol
Molecular Formula C22H33NO7
Exact Mass 423.225702 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID npyW2OBzrv
Name 1-tert-Butyl-2-keto-6-methyl-pyridine-3,4,5-tricarboxylic acid O3,O4-ditert-butyl ester O5-methyl ester
Alternate Name(s) 1-tert-Butyl-2-methyl-6-oxopyridine-3,4,5-tricarboxylic acid O4,O5-ditert-butyl ester O3-methyl ester 4-O,5-O-ditert-butyl 3-O-methyl 1-tert-butyl-2-methyl-6-oxopyridine-3,4,5-tricarboxylate O4,O5-ditert-butyl O3-methyl 1-tert-butyl-2-methyl-6-oxidanylidene-pyridine-3,4,5-tricarboxylate O4,O5-ditert-butyl O3-methyl 1-tert-butyl-2-methyl-6-oxo-pyridine-3,4,5-tricarboxylate
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Formula C22H33NO7
InChI InChI=1S/C22H33NO7/c1-12-13(17(25)28-11)14(18(26)29-21(5,6)7)15(19(27)30-22(8,9)10)16(24)23(12)20(2,3)4/h1-11H3
InChIKey NXODPEUPLZVIFM-UHFFFAOYSA-N
Molecular Weight 423.506 g/mol
SMILES C1(=C(C(C(=O)OC)=C(N(C1=O)C(C)(C)C)C)C(OC(C)(C)C)=O)C(OC(C)(C)C)=O
SPLASH splash10-0a4i-9546000000-eccc6172e2d7efb061cb
Source of Spectrum AH-138-789-1
Wiley ID 1612432