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(E)-2-(2-Hydrox-2-isobutylethylidene)-1-methylcyclopentane-(L)-tyrosylcarboxamide
SpectraBase Compound ID 5y2qg1SsZCz
InChI InChI=1S/C23H33NO5/c1-15(2)12-19(26)14-17-6-5-11-23(17,3)22(28)24-20(21(27)29-4)13-16-7-9-18(25)10-8-16/h7-10,14-15,19-20,25-26H,5-6,11-13H2,1-4H3,(H,24,28)/b17-14+/t19-,20-,23+/m0/s1
InChIKey TVRDZZSJFQGDOD-VOHYKZIESA-N
Mol Weight 403.5 g/mol
Molecular Formula C23H33NO5
Exact Mass 403.235873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cPMmuyyA6b
Name (E)-2-(2-Hydrox-2-isobutylethylidene)-1-methylcyclopentane-(L)-tyrosylcarboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H33NO5
InChI InChI=1S/C23H33NO5/c1-15(2)12-19(26)14-17-6-5-11-23(17,3)22(28)24-20(21(27)29-4)13-16-7-9-18(25)10-8-16/h7-10,14-15,19-20,25-26H,5-6,11-13H2,1-4H3,(H,24,28)/b17-14+/t19-,20-,23+/m0/s1
InChIKey TVRDZZSJFQGDOD-VOHYKZIESA-N
Molecular Weight 403.519 g/mol
SMILES O[C@](\C=C\1[C@](C(N[C@@](Cc2ccc(cc2)O)(C(=O)OC)[H])=O)(CCC1)C)(CC(C)C)[H]
SPLASH splash10-000i-2219000000-5cd9f9f7531407328ff1
Source of Spectrum J-58-6613-4
Synonyms Methyl (2S)-2-[({(1R,2E)-2-[(2S)-2-hydroxy-4-methylpentylidene]-1-methylcyclopentyl}carbonyl)amino]-3-(4-hydroxyphenyl)propanoate
Wiley ID 1370910