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6-R-(Acetylamidomethyl)-3-[4-(N-Benzyloxycarbonyl)-hexahydropyrazinyl-3-fluorophenyl]-1,3-oxazin-2-one
SpectraBase Compound ID DYqM1pwDCm7
InChI InChI=1S/C25H29FN4O5/c1-18(31)27-16-21-9-10-30(25(33)35-21)20-7-8-23(22(26)15-20)28-11-13-29(14-12-28)24(32)34-17-19-5-3-2-4-6-19/h2-8,15,21H,9-14,16-17H2,1H3,(H,27,31)/t21-/m1/s1
InChIKey WCWIPVBNDWFKDL-OAQYLSRUSA-N
Mol Weight 484.53 g/mol
Molecular Formula C25H29FN4O5
Exact Mass 484.212198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bnxozq2FdMX
Name 6-R-(Acetylamidomethyl)-3-[4-(N-Benzyloxycarbonyl)-hexahydropyrazinyl-3-fluorophenyl]-1,3-oxazin-2-one
Alternate Name(s) 6-(Acetylamidomethyl)-3-[4-(N-Benzyloxycarbonyl)-hexahydropyrazinyl-3-fluorophenyl]-1,3-oxazin-2-one benzyl 4-[4-((6R)-6-[(acetylamino)methyl]-2-oxodihydro-2H-1,3-oxazin-3(4H)-yl)-2-fluorophenyl]-1-piperazinecarboxylate 4-[4-[(6R)-6-(acetamidomethyl)-2-oxo-1,3-oxazinan-3-yl]-2-fluorophenyl]-1-piperazinecarboxylic acid (phenylmethyl) ester benzyl 4-[4-[(6R)-6-(acetamidomethyl)-2-oxo-1,3-oxazinan-3-yl]-2-fluorophenyl]piperazine-1-carboxylate benzyl 4-[4-[(6R)-6-(acetamidomethyl)-2-oxo-1,3-oxazinan-3-yl]-2-fluoro-phenyl]piperazine-1-carboxylate (phenylmethyl) 4-[4-[(6R)-6-(acetamidomethyl)-2-oxidanylidene-1,3-oxazinan-3-yl]-2-fluoranyl-phenyl]piperazine-1-carboxylate
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Formula C25H29FN4O5
InChI InChI=1S/C25H29FN4O5/c1-18(31)27-16-21-9-10-30(25(33)35-21)20-7-8-23(22(26)15-20)28-11-13-29(14-12-28)24(32)34-17-19-5-3-2-4-6-19/h2-8,15,21H,9-14,16-17H2,1H3,(H,27,31)/t21-/m1/s1
InChIKey WCWIPVBNDWFKDL-OAQYLSRUSA-N
Molecular Weight 484.528 g/mol
SMILES N(C(=O)C)C[C@]1(CCN(C(O1)=O)c1cc(F)c(N2CCN(C(OCc3ccccc3)=O)CC2)cc1)[H]
SPLASH splash10-0006-9023600000-8fb53accb0f5b39a2739
Source of Spectrum AT-39-6556-1
Wiley ID 854275