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5-Chloranyl-2,6-dimethyl-4-oxidanylidene-1H-pyridine-3-carboxylic acid
SpectraBase Compound ID LtlNv1kYaCE
InChI InChI=1S/C8H8ClNO3/c1-3-5(8(12)13)7(11)6(9)4(2)10-3/h1-2H3,(H,10,11)(H,12,13)
InChIKey ZXPKTYSXMAOZKM-UHFFFAOYSA-N
Mol Weight 201.61 g/mol
Molecular Formula C8H8ClNO3
Exact Mass 201.019271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jaqkHgMVc
Name 5-Chloranyl-2,6-dimethyl-4-oxidanylidene-1H-pyridine-3-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8ClNO3
InChI InChI=1S/C8H8ClNO3/c1-3-5(8(12)13)7(11)6(9)4(2)10-3/h1-2H3,(H,10,11)(H,12,13)
InChIKey ZXPKTYSXMAOZKM-UHFFFAOYSA-N
Molecular Weight 201.609 g/mol
SMILES Oc1c(C(=O)O)c(nc(c1Cl)C)C
SPLASH splash10-0frl-9300000000-c5ad1df278ab1a51603f
Source of Spectrum RB-1982-9638-0
Synonyms 5-Chloro-2,6-dimethyl-4-oxo-1H-pyridine-3-carboxylic acid 5-Chloro-4-keto-2,6-dimethyl-1H-pyridine-3-carboxylic acid
Wiley ID 1198572