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4-Acetylamino-nicotinic acid
SpectraBase Compound ID 1o9WZxuBjOO
InChI InChI=1S/C8H8N2O3/c1-5(11)10-7-2-3-9-4-6(7)8(12)13/h2-4H,1H3,(H,12,13)(H,9,10,11)
InChIKey RXWQRLWVSNNJDZ-UHFFFAOYSA-N
Mol Weight 180.16 g/mol
Molecular Formula C8H8N2O3
Exact Mass 180.053492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2a9ivNzAlEc
Name 4-Acetylamino-nicotinic acid
Alternate Name(s) 4-Acetamidonicotinic acid 4-Acetamido-3-pyridinecarboxylic acid 4-Acetamidopyridine-3-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8N2O3
InChI InChI=1S/C8H8N2O3/c1-5(11)10-7-2-3-9-4-6(7)8(12)13/h2-4H,1H3,(H,12,13)(H,9,10,11)
InChIKey RXWQRLWVSNNJDZ-UHFFFAOYSA-N
Molecular Weight 180.163 g/mol
SMILES N(c1c(C(=O)O)cncc1)C(=O)C
SPLASH splash10-00el-3900000000-f83803228684d83bb4ad
Source of Spectrum EMC-35-81-8
Wiley ID 1734604