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PJHFXDUFTXOAMP-UHFFFAOYSA-N

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PJHFXDUFTXOAMP-UHFFFAOYSA-N
SpectraBase Compound ID DXG59RQqkxI
InChI InChI=1S/C9H8N2O3S/c1-15-8-6-4-5(11(13)14)2-3-7(6)10-9(8)12/h2-4,8H,1H3,(H,10,12)
InChIKey PJHFXDUFTXOAMP-UHFFFAOYSA-N
Mol Weight 224.23 g/mol
Molecular Formula C9H8N2O3S
Exact Mass 224.025563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9gOXm0O8SER
Name 5-Nitro-3-methylthio-2(3H)-oxo-indole
CAS Registry Number 40800-69-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H8N2O3S
InChI InChI=1S/C9H8N2O3S/c1-15-8-6-4-5(11(13)14)2-3-7(6)10-9(8)12/h2-4,8H,1H3,(H,10,12)
InChIKey PJHFXDUFTXOAMP-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference P.G. Gassman, D.P. Gilbert, T.Y.Luh, J. Org. Chem. 42, 1340 (1977).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6