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Methyl (5Z,2S)-2-Di-tert-butoxycarbonylaminoeicos-5-enoate
SpectraBase Compound ID WhlSJrIYiQ
InChI InChI=1S/C26H49NO4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24(28)30-5)27-25(29)31-26(2,3)4/h19-20,23H,6-18,21-22H2,1-5H3,(H,27,29)/b20-19-/t23-/m0/s1
InChIKey ASDPLHHAZQESTQ-VIKCJLSCSA-N
Mol Weight 439.7 g/mol
Molecular Formula C26H49NO4
Exact Mass 439.366159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAgulkRzqhe
Name Methyl (5Z,2S)-2-Di-tert-butoxycarbonylaminoeicos-5-enoate
Alternate Name(s) (Z)-(S)-2-tert-Butoxycarbonylamino-icos-5-enoic acid methyl ester (Z,2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-eicosenoic acid methyl ester Methyl (Z,2S)-2-(tert-butoxycarbonylamino)icos-5-enoate Methyl (Z,2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]icos-5-enoate
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Formula C26H49NO4
InChI InChI=1S/C26H49NO4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24(28)30-5)27-25(29)31-26(2,3)4/h19-20,23H,6-18,21-22H2,1-5H3,(H,27,29)/b20-19-/t23-/m0/s1
InChIKey ASDPLHHAZQESTQ-VIKCJLSCSA-N
Molecular Weight 439.681 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(=O)OC)(CC\C=C/CCCCCCCCCCCCCC)[H]
SPLASH splash10-001i-0903000000-67e8944001baec3c1926
Source of Spectrum J-63-3743-11
Wiley ID 1384460