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XPMSBWFTJCFHQU-UHFFFAOYSA-N

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XPMSBWFTJCFHQU-UHFFFAOYSA-N
SpectraBase Compound ID D5CB8tqzPbq
InChI InChI=1S/C9H8N2O2/c1-11-8(13-9(12)10-11)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey XPMSBWFTJCFHQU-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C9H8N2O2
Exact Mass 176.058578 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ExByBJxTNs
Name 3-Methyl-2-phenyl-isosydnone
CAS Registry Number 24660-47-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H8N2O2
InChI InChI=1S/C9H8N2O2/c1-11-8(13-9(12)10-11)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey XPMSBWFTJCFHQU-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference G. Aranda, M. Dessolin, M. Golfier, Org. Magn. Resonance 18, 159 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3