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4-Chloro-3-[(5,6-(1,1,3,3-Tetramethylcyclopentano)-2-pyrazinyl)carboxamido]benzoic acid
SpectraBase Compound ID IFNVAvPc1Dz
InChI InChI=1S/C19H20ClN3O3/c1-18(2)9-19(3,4)15-14(18)21-8-13(22-15)16(24)23-12-7-10(17(25)26)5-6-11(12)20/h5-8H,9H2,1-4H3,(H,23,24)(H,25,26)
InChIKey OQRWUAFOLNDNMG-UHFFFAOYSA-N
Mol Weight 373.84 g/mol
Molecular Formula C19H20ClN3O3
Exact Mass 373.119319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GM7IuBsMDaK
Name 4-Chloro-3-[(5,6-(1,1,3,3-Tetramethylcyclopentano)-2-pyrazinyl)carboxamido]benzoic acid
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Formula C19H20ClN3O3
InChI InChI=1S/C19H20ClN3O3/c1-18(2)9-19(3,4)15-14(18)21-8-13(22-15)16(24)23-12-7-10(17(25)26)5-6-11(12)20/h5-8H,9H2,1-4H3,(H,23,24)(H,25,26)
InChIKey OQRWUAFOLNDNMG-UHFFFAOYSA-N
Molecular Weight 373.840 g/mol
SMILES N(C(c1nc2c(C(C)(C)CC2(C)C)nc1)=O)c1cc(C(=O)O)ccc1Cl
SPLASH splash10-002r-0309000000-3e1c4e4ce444d87540bf
Source of Spectrum F2-41-3072-9
Synonyms 4-Chloro-3-[[oxo-(5,5,7,7-tetramethyl-6H-cyclopenta[b]pyrazin-3-yl)methyl]amino]benzoic acid 4-Chloranyl-3-[(5,5,7,7-tetramethyl-6H-cyclopenta[b]pyrazin-3-yl)carbonylamino]benzoic acid
Wiley ID 1599778