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(2E)-2-(2-ketoindolin-3-ylidene)acetonitrile
SpectraBase Compound ID LgOiM2PXeP5
InChI InChI=1S/C10H6N2O/c11-6-5-8-7-3-1-2-4-9(7)12-10(8)13/h1-5H,(H,12,13)/b8-5+
InChIKey YLSUPMWMHFXGHW-VMPITWQZSA-N
Mol Weight 170.17 g/mol
Molecular Formula C10H6N2O
Exact Mass 170.048013 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2lvrNTcakx5
Name (2E)-2-(2-ketoindolin-3-ylidene)acetonitrile
Compound Number (E)-15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H6N2O
InChI InChI=1S/C10H6N2O/c11-6-5-8-7-3-1-2-4-9(7)12-10(8)13/h1-5H,(H,12,13)/b8-5+
InChIKey YLSUPMWMHFXGHW-VMPITWQZSA-N
Literature Reference Author M.S.MORALES-RIOS,M.GARCIA-VELGARA,H.CERVANTES-CUEVAS,C.ALVAR EZ-CISNEROS,P.JOSEPH
Literature Reference Citation MAGN.RES.CHEM.,38,172(2000)
Literature Reference DOI 10.1002/(sici)1097-458x(200003)38:3<172::aid-mrc618>3.3.co;2-4
Molecular Weight 170.170 g/mol
Solvent DMSO-D6
Source File Reference UWBS1217