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(E)-Trimethyl-5-(benzyloxycarbonylamino)-5-phenylpent-1-ene-1,4,4-tricarboxylate
SpectraBase Compound ID 4OJoI0Oma4U
InChI InChI=1S/C25H27NO8/c1-31-20(27)15-10-16-25(22(28)32-2,23(29)33-3)21(19-13-8-5-9-14-19)26-24(30)34-17-18-11-6-4-7-12-18/h4-15,21H,16-17H2,1-3H3,(H,26,30)/b15-10+
InChIKey DBNFWMLCJXDUSC-XNTDXEJSSA-N
Mol Weight 469.49 g/mol
Molecular Formula C25H27NO8
Exact Mass 469.173667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cctm9qV9pV
Name (E)-Trimethyl-5-(benzyloxycarbonylamino)-5-phenylpent-1-ene-1,4,4-tricarboxylate
Alternate Name(s) (E)-trimethyl 5-(((benzyloxy)carbonyl)amino)-5-phenylpent-1-ene-1,4,4-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27NO8
InChI InChI=1S/C25H27NO8/c1-31-20(27)15-10-16-25(22(28)32-2,23(29)33-3)21(19-13-8-5-9-14-19)26-24(30)34-17-18-11-6-4-7-12-18/h4-15,21H,16-17H2,1-3H3,(H,26,30)/b15-10+
InChIKey DBNFWMLCJXDUSC-XNTDXEJSSA-N
Literature Reference DOI 10.1002/adsc.201000658
Molecular Weight 469.490 g/mol
SMILES N(C(=O)OCc1ccccc1)C(C(C\C=C\C(=O)OC)(C(OC)=O)C(OC)=O)c1ccccc1
SPLASH splash10-0006-9210000000-056e8f159330db942795
Source of Spectrum ASC-352-2863/SM8-3b
Wiley ID 1764115