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Methyl 4-chloro-3-[(5,6-(1,1,3,3-tetramethylcyclopentano)-2-pyrazinyl)carboxamido]benzoate
SpectraBase Compound ID Ljpj72Bssq4
InChI InChI=1S/C20H22ClN3O3/c1-19(2)10-20(3,4)16-15(19)22-9-14(23-16)17(25)24-13-8-11(18(26)27-5)6-7-12(13)21/h6-9H,10H2,1-5H3,(H,24,25)
InChIKey CUBQYMMSOMSUSQ-UHFFFAOYSA-N
Mol Weight 387.87 g/mol
Molecular Formula C20H22ClN3O3
Exact Mass 387.134969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzkLuqDrtHs
Name Methyl 4-chloro-3-[(5,6-(1,1,3,3-tetramethylcyclopentano)-2-pyrazinyl)carboxamido]benzoate
Alternate Name(s) 4-Chloro-3-[[oxo-(5,5,7,7-tetramethyl-6H-cyclopenta[b]pyrazin-3-yl)methyl]amino]benzoic acid methyl ester Methyl 4-chloro-3-[(5,5,7,7-tetramethyl-6H-cyclopenta[b]pyrazine-3-carbonyl)amino]benzoate Methyl 4-chloranyl-3-[(5,5,7,7-tetramethyl-6H-cyclopenta[b]pyrazin-3-yl)carbonylamino]benzoate
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Formula C20H22ClN3O3
InChI InChI=1S/C20H22ClN3O3/c1-19(2)10-20(3,4)16-15(19)22-9-14(23-16)17(25)24-13-8-11(18(26)27-5)6-7-12(13)21/h6-9H,10H2,1-5H3,(H,24,25)
InChIKey CUBQYMMSOMSUSQ-UHFFFAOYSA-N
Molecular Weight 387.867 g/mol
SMILES N(C(c1nc2c(C(C)(C)CC2(C)C)nc1)=O)c1cc(C(=O)OC)ccc1Cl
SPLASH splash10-0ufr-0309000000-e5ec3e16bd57c9f52301
Source of Spectrum F2-41-3071-9
Wiley ID 1599696