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6-(tert-butylcarbamoyl)-4-(3-methoxyphenyl)nicotinic acid
SpectraBase Compound ID Ham5KaIVoeY
InChI InChI=1S/C18H20N2O4/c1-18(2,3)20-16(21)15-9-13(14(10-19-15)17(22)23)11-6-5-7-12(8-11)24-4/h5-10H,1-4H3,(H,20,21)(H,22,23)
InChIKey HAHGOBMZGIVITO-UHFFFAOYSA-N
Mol Weight 328.37 g/mol
Molecular Formula C18H20N2O4
Exact Mass 328.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFiaGPvyBOG
Name 6-(tert-butylcarbamoyl)-4-(3-methoxyphenyl)nicotinic acid
Alternate Name(s) 6-(tert-butylcarbamoyl)-4-(3-methoxyphenyl)pyridine-3-carboxylic acid 6-[(tert-butylamino)-oxomethyl]-4-(3-methoxyphenyl)-3-pyridinecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O4
InChI InChI=1S/C18H20N2O4/c1-18(2,3)20-16(21)15-9-13(14(10-19-15)17(22)23)11-6-5-7-12(8-11)24-4/h5-10H,1-4H3,(H,20,21)(H,22,23)
InChIKey HAHGOBMZGIVITO-UHFFFAOYSA-N
Molecular Weight 328.368 g/mol
SMILES N(C(c1cc(c(C(=O)O)cn1)-c1cc(OC)ccc1)=O)C(C)(C)C
SPLASH splash10-00o0-0694000000-654d790a5f0cd49ab175
Source of Spectrum F-51-9538-5
Wiley ID 793249