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1-Butanol, (2S)-2-[N-(benzyloxycarbonyl-(S)-phenylalanyl)amino]-3-methyl-
SpectraBase Compound ID 17uCPfSO9uB
InChI InChI=1S/C22H28N2O4/c1-16(2)20(14-25)23-21(26)19(13-17-9-5-3-6-10-17)24-22(27)28-15-18-11-7-4-8-12-18/h3-12,16,19-20,25H,13-15H2,1-2H3,(H,23,26)(H,24,27)
InChIKey YXRYGXSNTLGNDU-UHFFFAOYSA-N
Mol Weight 384.48 g/mol
Molecular Formula C22H28N2O4
Exact Mass 384.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hra4SG0Sh4w
Name 1-Butanol, (2S)-2-[N-(benzyloxycarbonyl-(S)-phenylalanyl)amino]-3-methyl-
Alternate Name(s) 1-Butanol, (2s)-2-[N-(benzyloxycarbonyl-(R)-phenylalanyl)amino]-3-methyl- (phenylmethyl) N-[1-[(3-methyl-1-oxidanyl-butan-2-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Benzyl 1-benzyl-2-([1-(hydroxymethyl)-2-methylpropyl]amino)-2-oxoethylcarbamate benzyl N-[1-benzyl-2-[[1-(hydroxymethyl)-2-methyl-propyl]amino]-2-oxo-ethyl]carbamate benzyl N-[1-[(1-hydroxy-3-methylbutan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate N-[1-benzyl-2-keto-2-[(2-methyl-1-methylol-propyl)amino]ethyl]carbamic acid benzyl ester N-[1-[(1-hydroxy-3-methylbutan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester
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Formula C22H28N2O4
InChI InChI=1S/C22H28N2O4/c1-16(2)20(14-25)23-21(26)19(13-17-9-5-3-6-10-17)24-22(27)28-15-18-11-7-4-8-12-18/h3-12,16,19-20,25H,13-15H2,1-2H3,(H,23,26)(H,24,27)
InChIKey YXRYGXSNTLGNDU-UHFFFAOYSA-N
Molecular Weight 384.476 g/mol
SMILES N(C(OCc1ccccc1)=O)C(C(=O)NC(CO)C(C)C)Cc1ccccc1
SPLASH splash10-0006-9220000000-6c2ffd916879a639f0ef
Wiley ID 1492539