For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Neoechinulin A

Compound with spectra: 1 NMR, and 1 MS (GC)

Neoechinulin A
SpectraBase Compound ID Gqo86g6ZJt3
InChI InChI=1S/C19H21N3O2/c1-5-19(3,4)16-13(12-8-6-7-9-14(12)21-16)10-15-18(24)20-11(2)17(23)22-15/h5-11,21H,1H2,2-4H3,(H,20,24)(H,22,23)/b15-10-/t11-/m0/s1
InChIKey MYRPIYZIAHOECW-SAIXKJTDSA-N
Mol Weight 323.4 g/mol
Molecular Formula C19H21N3O2
Exact Mass 323.163377 g/mol
Enantiomer InChIKey MYRPIYZIAHOECW-MKVLZVNKSA-N
Racemate InChIKey MYRPIYZIAHOECW-GDNBJRDFSA-N

View Spectrum of Neoechinulin A

MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum KC-1977-7-715

View Spectrum of Neoechinulin A

13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
  • (3S,6Z)-3-methyl-6-[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methylidene]piperazine-2,5-dione
  • (3Z,6S)-3-[[2-(1,1-dimethylallyl)-1H-indol-3-yl]methylene]-6-methyl-piperazine-2,5-dione
  • (3Z,6S)-3-[[2-(1,1-dimethylallyl)-1H-indol-3-yl]methylene]-6-methyl-piperazine-2,5-quinone
Neoechinulin A
Piperazinetrione, [[2-(1,1-dimethyl-2-propenyl)-1H-indol-3-yl]methylene]-, (Z)-
Neoechinulin B
(5Z)-3-(3-chlorophenyl)-5-[(2-methyl-1H-indol-3-yl)methylene]-2,4-imidazolidinedione
Preechinulin
(Z)-N-Acetyl-5-bromo-2-ethoxycarbonyl-5-methoxydehydrotryptophan Methyl ester
FELLUTANINE-C
(5Z)-2-Imino-5-[(2-methyl-1H-indol-3-yl)methylene]-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
5-[(2-benzoyl-1H-indol-3-yl)methylene]-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
3-Ethoxymethylindol-2-yl piperidin-4-yl ketone ethylene acetal
2-(2'-TRYPTOPHANYL)-ACETIC-ACID
Title Journal or Book Year
13C-NMR spectra and streochemistry of isoechinulins A, B and C. Agricultural and Biological Chemistry 1979
Neoechinulin A
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.