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E-1,4-Di(2-N-ter-butoxycarbonylaniline)-2-butene
SpectraBase Compound ID 1MeYJHB139l
InChI InChI=1S/C26H34N2O4/c1-25(2,3)31-23(29)27-21-17-11-9-15-19(21)13-7-8-14-20-16-10-12-18-22(20)28-24(30)32-26(4,5)6/h7-12,15-18H,13-14H2,1-6H3,(H,27,29)(H,28,30)/b8-7+
InChIKey BLYJRRSHPGUFBU-BQYQJAHWSA-N
Mol Weight 438.6 g/mol
Molecular Formula C26H34N2O4
Exact Mass 438.251858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D5lnpSXZiQL
Name E-1,4-Di(2-N-ter-butoxycarbonylaniline)-2-butene
Comments Less than 3 mono-isotopic peaks
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Formula C26H34N2O4
InChI InChI=1S/C26H34N2O4/c1-25(2,3)31-23(29)27-21-17-11-9-15-19(21)13-7-8-14-20-16-10-12-18-22(20)28-24(30)32-26(4,5)6/h7-12,15-18H,13-14H2,1-6H3,(H,27,29)(H,28,30)/b8-7+
InChIKey BLYJRRSHPGUFBU-BQYQJAHWSA-N
Molecular Weight 438.568 g/mol
SMILES N(C(OC(C)(C)C)=O)c1c(C\C=C\Cc2c(NC(OC(C)(C)C)=O)cccc2)cccc1
SPLASH splash10-001i-0900000000-8b2312833c42f8d5bb33
Source of Spectrum F-66-6968-7
Wiley ID 1713021