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4-[2-[(3,5-dichlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID JTs3cPp5sbf
InChI InChI=1S/C18H26Cl2N4O3/c1-18(2,3)27-17(26)24-8-6-23(7-9-24)5-4-21-16(25)22-15-11-13(19)10-14(20)12-15/h10-12H,4-9H2,1-3H3,(H2,21,22,25)
InChIKey MQBABGWJQMSDIZ-UHFFFAOYSA-N
Mol Weight 417.34 g/mol
Molecular Formula C18H26Cl2N4O3
Exact Mass 416.138196 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3wM8in8zI7
Name 4-[2-[(3,5-dichlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylic acid tert-butyl ester
Alternate Name(s) 4-[2-[[(3,5-dichloroanilino)-oxomethyl]amino]ethyl]-1-piperazinecarboxylic acid tert-butyl ester tert-Butyl 4-[2-[(3,5-dichlorophenyl)carbamoylamino]ethyl]piperazine-1-carboxylate tert-Butyl 4-[2-[[3,5-bis(chloranyl)phenyl]carbamoylamino]ethyl]piperazine-1-carboxylate
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Formula C18H26Cl2N4O3
InChI InChI=1S/C18H26Cl2N4O3/c1-18(2,3)27-17(26)24-8-6-23(7-9-24)5-4-21-16(25)22-15-11-13(19)10-14(20)12-15/h10-12H,4-9H2,1-3H3,(H2,21,22,25)
InChIKey MQBABGWJQMSDIZ-UHFFFAOYSA-N
Molecular Weight 417.337 g/mol
SMILES N(C(Nc1cc(cc(c1)Cl)Cl)=O)CCN1CCN(C(OC(C)(C)C)=O)CC1
SPLASH splash10-0007-5910000000-735f654cb6cb139b2712
Wiley ID 1438839