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3-o-TOLYL-4(3H)-PTERIDINONE

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3-o-TOLYL-4(3H)-PTERIDINONE
SpectraBase Compound ID 6hJnCbv8bJi
InChI InChI=1S/C13H10N4O/c1-9-4-2-3-5-10(9)17-8-16-12-11(13(17)18)14-6-7-15-12/h2-8H,1H3
InChIKey RYCMEKLQEWGKBF-UHFFFAOYSA-N
Mol Weight 238.25 g/mol
Molecular Formula C13H10N4O
Exact Mass 238.085461 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H7llT5ng7dg
Name 3-o-TOLYL-4(3H)-PTERIDINONE
Source of Sample E. Felder, Bracco Industria Chimica S.p.A., Milan, Italy
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N4O
InChI InChI=1S/C13H10N4O/c1-9-4-2-3-5-10(9)17-8-16-12-11(13(17)18)14-6-7-15-12/h2-8H,1H3
InChIKey RYCMEKLQEWGKBF-UHFFFAOYSA-N
Melting Point 166.5-172.5C
Molecular Weight 238.25
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PTERIDINONE, 4/3H/-, 3-O-TOLYL-,