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AMINO-[2-(3-METHYLBUTYL)-3-OXO-2,3-DIHYDRO-1H-ISOINDOL-1-YLIDENE]-ACETONITRILE;(E)-ISOMER
SpectraBase Compound ID DRZ3O1SwiHn
InChI InChI=1S/C15H17N3O/c1-10(2)7-8-18-14(13(17)9-16)11-5-3-4-6-12(11)15(18)19/h3-6,10H,7-8,17H2,1-2H3/b14-13+
InChIKey NFIMFPGQCABRFX-BUHFOSPRSA-N
Mol Weight 255.32 g/mol
Molecular Formula C15H17N3O
Exact Mass 255.137162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D7mqk0bI3ZX
Name AMINO-[2-(3-METHYLBUTYL)-3-OXO-2,3-DIHYDRO-1H-ISOINDOL-1-YLIDENE]-ACETONITRILE;(E)-ISOMER
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H17N3O
InChI InChI=1S/C15H17N3O/c1-10(2)7-8-18-14(13(17)9-16)11-5-3-4-6-12(11)15(18)19/h3-6,10H,7-8,17H2,1-2H3/b14-13+
InChIKey NFIMFPGQCABRFX-BUHFOSPRSA-N
Literature Reference Author T.OPATZ,D.FERENC
Literature Reference Citation J.ORG.CHEM.,69,8496(2004)
Literature Reference DOI 10.1021/jo0486802
Molecular Weight 255.319 g/mol
Solvent DMSO-D6
Source File Reference UWVN22928