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Methyl (2S)-2-[(2S)-2-t-Butoxycarbonylaminohexadecanoylamino]propionate
SpectraBase Compound ID DsbSFVXbN1m
InChI InChI=1S/C25H48N2O5/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-21(27-24(30)32-25(3,4)5)22(28)26-20(2)23(29)31-6/h20-21H,7-19H2,1-6H3,(H,26,28)(H,27,30)/t20-,21-/m0/s1
InChIKey VFOMKTBDLJDTLV-SFTDATJTSA-N
Mol Weight 456.7 g/mol
Molecular Formula C25H48N2O5
Exact Mass 456.356323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxfbkTo5ffJ
Name Methyl (2S)-2-[(2S)-2-t-Butoxycarbonylaminohexadecanoylamino]propionate
Alternate Name(s) Methyl (2S)-2-({(2S)-2-[(tert-butoxycarbonyl)amino]hexadecanoyl}amino)propanoate
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Formula C25H48N2O5
InChI InChI=1S/C25H48N2O5/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-21(27-24(30)32-25(3,4)5)22(28)26-20(2)23(29)31-6/h20-21H,7-19H2,1-6H3,(H,26,28)(H,27,30)/t20-,21-/m0/s1
InChIKey VFOMKTBDLJDTLV-SFTDATJTSA-N
Molecular Weight 456.668 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(N[C@](C(=O)OC)(C)[H])=O)(CCCCCCCCCCCCCC)[H]
SPLASH splash10-0adi-8290000000-fe966451599c4caba98e
Source of Spectrum QC-7-863-14
Wiley ID 869177