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1(2H)-Pyrazinecarboxylic acid, 4-(4-amino-2-chlorophenyl)tetrahydro-, ethyl ester
SpectraBase Compound ID J0D17axLCX3
InChI InChI=1S/C13H18ClN3O2/c1-2-19-13(18)17-7-5-16(6-8-17)12-4-3-10(15)9-11(12)14/h3-4,9H,2,5-8,15H2,1H3
InChIKey QKEZBJNKEHFSOD-UHFFFAOYSA-N
Mol Weight 283.76 g/mol
Molecular Formula C13H18ClN3O2
Exact Mass 283.108755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zBobh8siF5
Name 1(2H)-Pyrazinecarboxylic acid, 4-(4-amino-2-chlorophenyl)tetrahydro-, ethyl ester
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Formula C13H18ClN3O2
InChI InChI=1S/C13H18ClN3O2/c1-2-19-13(18)17-7-5-16(6-8-17)12-4-3-10(15)9-11(12)14/h3-4,9H,2,5-8,15H2,1H3
InChIKey QKEZBJNKEHFSOD-UHFFFAOYSA-N
Molecular Weight 283.759 g/mol
SMILES Nc1ccc(N2CCN(C(=O)OCC)CC2)c(c1)Cl
SPLASH splash10-0kai-5920000000-3fd699f8a39d32b6d807
Source of Spectrum IY-1-4654-9
Synonyms 4-(4-amino-2-chlorophenyl)-1-piperazinecarboxylic acid ethyl ester Ethyl 4-(4-amino-2-chlorophenyl)piperazine-1-carboxylate Ethyl 4-(4-amino-2-chloro-phenyl)piperazine-1-carboxylate Ethyl 4-(4-azanyl-2-chloranyl-phenyl)piperazine-1-carboxylate
Wiley ID 1654532