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(E)-Trimethyl-5-(tert-butoxycarbonylamino)-5-phenylpent-1-ene-1,4,4-tricarboxylate
SpectraBase Compound ID GrapSkzx3mc
InChI InChI=1S/C22H29NO8/c1-21(2,3)31-20(27)23-17(15-11-8-7-9-12-15)22(18(25)29-5,19(26)30-6)14-10-13-16(24)28-4/h7-13,17H,14H2,1-6H3,(H,23,27)/b13-10+
InChIKey LBIKPMPFNRVOAI-JLHYYAGUSA-N
Mol Weight 435.47 g/mol
Molecular Formula C22H29NO8
Exact Mass 435.189317 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1BKRCQidIGF
Name (E)-Trimethyl-5-(tert-butoxycarbonylamino)-5-phenylpent-1-ene-1,4,4-tricarboxylate
Alternate Name(s) (E)-trimethyl 5-((tert-butoxycarbonyl)amino)-5-phenylpent-1-ene-1,4,4-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO8
InChI InChI=1S/C22H29NO8/c1-21(2,3)31-20(27)23-17(15-11-8-7-9-12-15)22(18(25)29-5,19(26)30-6)14-10-13-16(24)28-4/h7-13,17H,14H2,1-6H3,(H,23,27)/b13-10+
InChIKey LBIKPMPFNRVOAI-JLHYYAGUSA-N
Literature Reference DOI 10.1002/adsc.201000658
Molecular Weight 435.473 g/mol
SMILES N(C(=O)OC(C)(C)C)C(C(C\C=C\C(OC)=O)(C(OC)=O)C(OC)=O)c1ccccc1
SPLASH splash10-0a4i-5900000000-fee72e67d2e48ed20d3d
Source of Spectrum ASC-352-2863/SM8-3a
Wiley ID 1764114