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N-Hexyl-N-benzyloxycarbonyl-DL-phenylalanin amide (Z-DL-Phe-NH-(CH2)5CH3)
SpectraBase Compound ID GyKWPJzUFNU
InChI InChI=1S/C23H30N2O3/c1-2-3-4-11-16-25(23(27)28-18-20-14-9-6-10-15-20)22(26)21(24)17-19-12-7-5-8-13-19/h5-10,12-15,21H,2-4,11,16-18,24H2,1H3
InChIKey ABVWEICKJQZQFS-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C23H30N2O3
Exact Mass 382.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LSGpEZ6vUrM
Name N-Hexyl-N-benzyloxycarbonyl-DL-phenylalanin amide (Z-DL-Phe-NH-(CH2)5CH3)
Alternate Name(s) benzyl 2-amino-3-phenylpropanoyl(hexyl)carbamate N-Hexyl-N-benzyloxycarbonyl-DL-vphenylalanin)amide (Z-DL-Phe-NH-(CH2)5CH3)
Comments Less than 3 mono-isotopic peaks
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Formula C23H30N2O3
InChI InChI=1S/C23H30N2O3/c1-2-3-4-11-16-25(23(27)28-18-20-14-9-6-10-15-20)22(26)21(24)17-19-12-7-5-8-13-19/h5-10,12-15,21H,2-4,11,16-18,24H2,1H3
InChIKey ABVWEICKJQZQFS-UHFFFAOYSA-N
Molecular Weight 382.504 g/mol
SMILES NC(C(N(C(OCc1ccccc1)=O)CCCCCC)=O)Cc1ccccc1
SPLASH splash10-0006-9000000000-ae01e768fdaf6897e83b
Source of Spectrum AJ-69-1709-5
Wiley ID 773682