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4-[2-[(4-chlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID CeM829yT8ry
InChI InChI=1S/C18H27ClN4O3/c1-18(2,3)26-17(25)23-12-10-22(11-13-23)9-8-20-16(24)21-15-6-4-14(19)5-7-15/h4-7H,8-13H2,1-3H3,(H2,20,21,24)
InChIKey ZZDZAIQFAYFALR-UHFFFAOYSA-N
Mol Weight 382.89 g/mol
Molecular Formula C18H27ClN4O3
Exact Mass 382.177168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CrUsG8xdSeC
Name 4-[2-[(4-chlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylic acid tert-butyl ester
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Formula C18H27ClN4O3
InChI InChI=1S/C18H27ClN4O3/c1-18(2,3)26-17(25)23-12-10-22(11-13-23)9-8-20-16(24)21-15-6-4-14(19)5-7-15/h4-7H,8-13H2,1-3H3,(H2,20,21,24)
InChIKey ZZDZAIQFAYFALR-UHFFFAOYSA-N
Molecular Weight 382.892 g/mol
SMILES N(C(Nc1ccc(cc1)Cl)=O)CCN1CCN(C(OC(C)(C)C)=O)CC1
SPLASH splash10-0006-9700000000-8abfde92b34a0fb70aae
Synonyms 4-[2-[[(4-chloroanilino)-oxomethyl]amino]ethyl]-1-piperazinecarboxylic acid tert-butyl ester tert-Butyl 4-[2-[(4-chlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylate
Wiley ID 1446985