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1-[(E)-2'-(1"-Butoxycarbonyl-3",4"dimethyl-5"-ethoxycarbonyl-[1"H]-pyrrol-2-yl)vinyl]-4-[(E)2"'-(1"'-tert-butoxycarbonyl-[1""H]pyrrol-2'"'-yl)vinyl]benzene
SpectraBase Compound ID HMo6wbAFPWF
InChI InChI=1S/C33H40N2O6/c1-10-39-29(36)28-23(3)22(2)27(35(28)31(38)41-33(7,8)9)20-18-25-15-13-24(14-16-25)17-19-26-12-11-21-34(26)30(37)40-32(4,5)6/h11-21H,10H2,1-9H3/b19-17+,20-18+
InChIKey KYGKTLVSEZYDAS-XPWSMXQVSA-N
Mol Weight 560.7 g/mol
Molecular Formula C33H40N2O6
Exact Mass 560.288637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3fO21AJGD8
Name 1-[(E)-2'-(1"-Butoxycarbonyl-3",4"dimethyl-5"-ethoxycarbonyl-[1"H]-pyrrol-2-yl)vinyl]-4-[(E)2"'-(1"'-tert-butoxycarbonyl-[1""H]pyrrol-2'"'-yl)vinyl]benzene
Alternate Name(s) 1-tert-Butyl 2-ethyl 5-[(E)-2-(4-{(E)-2-[1-(tert-butoxycarbonyl)-1H-pyrrol-2-yl]ethenyl}phenyl)ethenyl]-3,4-dimethyl-1H-pyrrole-1,2-dicarboxylate 1-[(E)-2'-(1''-tert-Butoxycarbonyl-3'',4''-dimethyl-5''-ethoxycarbonyl-[1''H]-pyrrol-2-yl)vinyl]-4[(E)-2'''-(1'''-tert-butoxycarbonyl-[1''''H]-pyrrol-2''''-yl)vinyl]benzene 1-[(E)-2'-(1''-Butoxycarbonyl-3'',4''dimethyl-5''-ethoxycarbonyl-[1''H]-pyrrol-2-yl)vinyl]-4-[(E)2'''-(1'''-tert-butoxycarbonyl-[1''''H]pyrrol-2''''-yl)vinyl]benzene 1-[(E)-2'-(1''-tert-Butoxycarbonyl-3'',4''-dimethyl-5''-ethoxycarbonyl-[1''H]-pyrrol-2-yl)vinyl]-4[(E)-2'''-(1'''-tert-butoxycarbonyl-[1''''H]-pyrrol-2''''-yl)vinyl]benzene
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Formula C33H40N2O6
InChI InChI=1S/C33H40N2O6/c1-10-39-29(36)28-23(3)22(2)27(35(28)31(38)41-33(7,8)9)20-18-25-15-13-24(14-16-25)17-19-26-12-11-21-34(26)30(37)40-32(4,5)6/h11-21H,10H2,1-9H3/b19-17+,20-18+
InChIKey KYGKTLVSEZYDAS-XPWSMXQVSA-N
Molecular Weight 560.691 g/mol
SMILES c1([n](c(c(c1C)C)C(=O)OCC)C(OC(C)(C)C)=O)\C=C\c1ccc(\C=C\c2[n](C(OC(C)(C)C)=O)ccc2)cc1
SPLASH splash10-03di-9008110000-92b0dba7ec35537333d7
Source of Spectrum QE-7-372-10
Wiley ID 1557021