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7-methylindole-2,3-dione

View entire compound with spectra: 4 NMR, 2 FTIR, and 2 MS (GC)

7-methylindole-2,3-dione
SpectraBase Compound ID 6QLh1UtKvHw
InChI InChI=1S/C9H7NO2/c1-5-3-2-4-6-7(5)10-9(12)8(6)11/h2-4H,1H3,(H,10,11,12)
InChIKey UEHZKEABUOAZSH-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C9H7NO2
Exact Mass 161.047678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AWtb97siz5p
Name 7-Methyl-isatin
CAS Registry Number 1127-59-9
Comments P.G.GASSM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H7NO2
InChI InChI=1S/C9H7NO2/c1-5-3-2-4-6-7(5)10-9(12)8(6)11/h2-4H,1H3,(H,10,11,12)
InChIKey UEHZKEABUOAZSH-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference P.G. Gassman, B.W. Cue, T.Y.Luh, J. Org. Chem. 42, 1344 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6