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2,2,5-trimethyl-3,6-dioxo-1H-pyridine-4-carboxylic acid propyl ester
SpectraBase Compound ID 2jwjyGbByAP
InChI InChI=1S/C12H17NO4/c1-5-6-17-11(16)8-7(2)10(15)13-12(3,4)9(8)14/h5-6H2,1-4H3,(H,13,15)
InChIKey PFJFJZAKKRMLHX-UHFFFAOYSA-N
Mol Weight 239.27 g/mol
Molecular Formula C12H17NO4
Exact Mass 239.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kqTEIwpC7x
Name 2,2,5-trimethyl-3,6-dioxo-1H-pyridine-4-carboxylic acid propyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO4
InChI InChI=1S/C12H17NO4/c1-5-6-17-11(16)8-7(2)10(15)13-12(3,4)9(8)14/h5-6H2,1-4H3,(H,13,15)
InChIKey PFJFJZAKKRMLHX-UHFFFAOYSA-N
Molecular Weight 239.271 g/mol
SMILES N1C(C(=C(C(C1(C)C)=O)C(=O)OCCC)C)=O
SPLASH splash10-02ai-2910000000-0249df99fead03aeea25
Source of Spectrum F-70-4978-15
Synonyms 3,6-Diketo-2,2,5-trimethyl-1H-pyridine-4-carboxylic acid propyl ester Propyl 2,2,5-trimethyl-3,6-bis(oxidanylidene)-1H-pyridine-4-carboxylate Propyl 2,2,5-trimethyl-3,6-dioxo-1H-pyridine-4-carboxylate
Wiley ID 1597083