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N-Carbobenzoxy-3-fluoro-4-(N-carbobenzoxypiperazinyl)aniline
SpectraBase Compound ID AuCm2wpjaWR
InChI InChI=1S/C26H26FN3O4/c27-23-17-22(28-25(31)33-18-20-7-3-1-4-8-20)11-12-24(23)29-13-15-30(16-14-29)26(32)34-19-21-9-5-2-6-10-21/h1-12,17H,13-16,18-19H2,(H,28,31)
InChIKey OPWCRBOOVRSYHY-UHFFFAOYSA-N
Mol Weight 463.51 g/mol
Molecular Formula C26H26FN3O4
Exact Mass 463.190734 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4202HsPofo
Name N-Carbobenzoxy-3-fluoro-4-(N-carbobenzoxypiperazinyl)aniline
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Formula C26H26FN3O4
InChI InChI=1S/C26H26FN3O4/c27-23-17-22(28-25(31)33-18-20-7-3-1-4-8-20)11-12-24(23)29-13-15-30(16-14-29)26(32)34-19-21-9-5-2-6-10-21/h1-12,17H,13-16,18-19H2,(H,28,31)
InChIKey OPWCRBOOVRSYHY-UHFFFAOYSA-N
Molecular Weight 463.509 g/mol
SMILES N(C(=O)OCc1ccccc1)c1ccc(N2CCN(C(OCc3ccccc3)=O)CC2)c(c1)F
SPLASH splash10-0006-9035200000-63ccf2deb286154dce15
Source of Spectrum E1-39-676-4
Synonyms N-Carbobenzoxy-3-fluoro-4-(N-carbobenzoxypiperazin-4-yl)aniline benzyl 4-(4-{[(benzyloxy)carbonyl]amino}-2-fluorophenyl)-1-piperazinecarboxylate 4-[2-fluoro-4-(phenylmethoxycarbonylamino)phenyl]-1-piperazinecarboxylic acid (phenylmethyl) ester benzyl 4-[2-fluoro-4-(phenylmethoxycarbonylamino)phenyl]piperazine-1-carboxylate benzyl 4-[4-(benzyloxycarbonylamino)-2-fluoro-phenyl]piperazine-1-carboxylate (phenylmethyl) 4-[2-fluoranyl-4-(phenylmethoxycarbonylamino)phenyl]piperazine-1-carboxylate
Wiley ID 1598666