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(2S,5Z,8Z,11Z,14Z)-2-[bis(tert-butoxycarbonyl)amino]eicosa-5,8,11,14-tetraenoic acid methyl ester
SpectraBase Compound ID JT5U73xLW9q
InChI InChI=1S/C31H51NO6/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/h13-14,16-17,19-20,22-23,26H,9-12,15,18,21,24-25H2,1-8H3/b14-13-,17-16-,20-19-,23-22-/t26-/m0/s1
InChIKey BMDQOYACKSYOEY-SWUKPWHOSA-N
Mol Weight 533.8 g/mol
Molecular Formula C31H51NO6
Exact Mass 533.371638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cd8dG2Zq6YD
Name (2S,5Z,8Z,11Z,14Z)-2-[bis(tert-butoxycarbonyl)amino]eicosa-5,8,11,14-tetraenoic acid methyl ester
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Formula C31H51NO6
InChI InChI=1S/C31H51NO6/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/h13-14,16-17,19-20,22-23,26H,9-12,15,18,21,24-25H2,1-8H3/b14-13-,17-16-,20-19-,23-22-/t26-/m0/s1
InChIKey BMDQOYACKSYOEY-SWUKPWHOSA-N
Molecular Weight 533.750 g/mol
SMILES C(N(C(OC(C)(C)C)=O)[C@](C(=O)OC)(CC\C=C/C\C=C/C\C=C/C\C=C/CCCCC)[H])(OC(C)(C)C)=O
SPLASH splash10-004l-0900000000-f4f1521e88d3db46caa1
Source of Spectrum J-63-3743-10
Synonyms (2S,5Z,8Z,11Z,14Z)-2-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]eicosa-5,8,11,14-tetraenoic acid methyl ester Methyl (2S,5Z,8Z,11Z,14Z)-2-[bis(tert-butoxycarbonyl)amino]icosa-5,8,11,14-tetraenoate Methyl (2S,5Z,8Z,11Z,14Z)-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]icosa-5,8,11,14-tetraenoate
Wiley ID 1403717