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(E)-2-Benzyl-2-(tert-butoxycarbonyl-methoxymethyl-amino)-5-phenyl-pent-4-enoic acid 2-(2-hydroxy-phenyl)-ethyl ester
SpectraBase Compound ID 6HS0jYxcGnp
InChI InChI=1S/C33H39NO6/c1-32(2,3)40-31(37)34(25-38-4)33(24-27-16-9-6-10-17-27,22-13-18-26-14-7-5-8-15-26)30(36)39-23-21-28-19-11-12-20-29(28)35/h5-20,35H,21-25H2,1-4H3/b18-13+
InChIKey PLWVZQLNLSUMQO-QGOAFFKASA-N
Mol Weight 545.7 g/mol
Molecular Formula C33H39NO6
Exact Mass 545.277738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4cYqgLyvee1
Name (E)-2-Benzyl-2-(tert-butoxycarbonyl-methoxymethyl-amino)-5-phenyl-pent-4-enoic acid 2-(2-hydroxy-phenyl)-ethyl ester
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Formula C33H39NO6
InChI InChI=1S/C33H39NO6/c1-32(2,3)40-31(37)34(25-38-4)33(24-27-16-9-6-10-17-27,22-13-18-26-14-7-5-8-15-26)30(36)39-23-21-28-19-11-12-20-29(28)35/h5-20,35H,21-25H2,1-4H3/b18-13+
InChIKey PLWVZQLNLSUMQO-QGOAFFKASA-N
Molecular Weight 545.676 g/mol
SMILES Oc1c(CCOC(C(N(C(OC(C)(C)C)=O)COC)(Cc2ccccc2)C\C=C\c2ccccc2)=O)cccc1
SPLASH splash10-00di-3922010000-1259e771945b264624f2
Source of Spectrum F-59-973-24
Synonyms 2-Benzyl-2-(tert-Butoxycarbonylmethoxymethylamino)-5-phenylpent-4-enoic acid 2-(2-hydroxyphenyl)ethyl ester (E)-2-[methoxymethyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-phenyl-2-(phenylmethyl)-4-pentenoic acid 2-(2-hydroxyphenyl)ethyl ester 2-(2-hydroxyphenyl)ethyl (E)-2-benzyl-2-[methoxymethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-phenylpent-4-enoate 2-(2-hydroxyphenyl)ethyl (E)-2-benzyl-2-[tert-butoxycarbonyl(methoxymethyl)amino]-5-phenyl-pent-4-enoate 2-(2-hydroxyphenyl)ethyl (E)-2-[methoxymethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-phenyl-2-(phenylmethyl)pent-4-enoate
Wiley ID 1676973