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(Z,2S)-2-[bis(tert-butoxycarbonyl)amino]eicos-5-enoic acid methyl ester
SpectraBase Compound ID ElduRpNxSt
InChI InChI=1S/C31H57NO6/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27(33)36-8)32(28(34)37-30(2,3)4)29(35)38-31(5,6)7/h22-23,26H,9-21,24-25H2,1-8H3/b23-22-/t26-/m0/s1
InChIKey WJEROEWYBOGSQH-BVBZGZSMSA-N
Mol Weight 539.8 g/mol
Molecular Formula C31H57NO6
Exact Mass 539.418589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yzwLMzowVH
Name (Z,2S)-2-[bis(tert-butoxycarbonyl)amino]eicos-5-enoic acid methyl ester
Alternate Name(s) (Z,2S)-2-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-eicosenoic acid methyl ester Methyl (Z,2S)-2-[bis(tert-butoxycarbonyl)amino]icos-5-enoate Methyl (Z,2S)-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]icos-5-enoate
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Formula C31H57NO6
InChI InChI=1S/C31H57NO6/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27(33)36-8)32(28(34)37-30(2,3)4)29(35)38-31(5,6)7/h22-23,26H,9-21,24-25H2,1-8H3/b23-22-/t26-/m0/s1
InChIKey WJEROEWYBOGSQH-BVBZGZSMSA-N
Molecular Weight 539.798 g/mol
SMILES C(N(C(OC(C)(C)C)=O)[C@](C(=O)OC)(CC\C=C/CCCCCCCCCCCCCC)[H])(OC(C)(C)C)=O
SPLASH splash10-001i-0942000000-48d3e1cfc3fc85d24f3e
Source of Spectrum QC-9-3387-10
Wiley ID 870796