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1-Pyrazineacetamide, N-[2-[(2-chloro-4-nitrophenyl)amino]ethyl]hexahydro-4-(phenylmethyl)-
SpectraBase Compound ID IEYkhh5k8Ey
InChI InChI=1S/C21H26ClN5O3/c22-19-14-18(27(29)30)6-7-20(19)23-8-9-24-21(28)16-26-12-10-25(11-13-26)15-17-4-2-1-3-5-17/h1-7,14,23H,8-13,15-16H2,(H,24,28)
InChIKey TVSKXLGXGJDVEO-UHFFFAOYSA-N
Mol Weight 431.92 g/mol
Molecular Formula C21H26ClN5O3
Exact Mass 431.172417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vNgFyzPNI
Name 1-Pyrazineacetamide, N-[2-[(2-chloro-4-nitrophenyl)amino]ethyl]hexahydro-4-(phenylmethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26ClN5O3
InChI InChI=1S/C21H26ClN5O3/c22-19-14-18(27(29)30)6-7-20(19)23-8-9-24-21(28)16-26-12-10-25(11-13-26)15-17-4-2-1-3-5-17/h1-7,14,23H,8-13,15-16H2,(H,24,28)
InChIKey TVSKXLGXGJDVEO-UHFFFAOYSA-N
Molecular Weight 431.924 g/mol
SMILES N(C(CN1CCN(CC1)Cc1ccccc1)=O)CCNc1c(cc(N(=O)=O)cc1)Cl
SPLASH splash10-000f-8900000000-8735e13bad9d4553dca9
Source of Spectrum IY-1-4666-5
Synonyms N-[2-(2-chloro-4-nitroanilino)ethyl]-2-[4-(phenylmethyl)-1-piperazinyl]acetamide 2-(4-benzylpiperazin-1-yl)-N-[2-(2-chloro-4-nitroanilino)ethyl]acetamide 2-(4-benzylpiperazin-1-yl)-N-[2-(2-chloro-4-nitro-anilino)ethyl]acetamide N-[2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl]-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide
Wiley ID 1654648