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8-Cyano-6,10-diferrocenyl-3-imino-2-oxopyrano[4,3-d]pyrazolo[1,5-a]pyridine
SpectraBase Compound ID KEZVOdGoJBX
InChI InChI=1S/C21H12N4O2.2C5H5.2Fe/c22-11-15-14-9-18(13-7-3-4-8-13)27-21(26)19(14)20(23)25-17(15)10-16(24-25)12-5-1-2-6-12;2*1-2-4-5-3-1;;/h1-10,23-24H;2*1-5H;;
InChIKey XVMJGRLHKLVIBZ-UHFFFAOYSA-N
Mol Weight 594.23 g/mol
Molecular Formula C31H22Fe2N4O2
Exact Mass 594.044148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYMAbyslmIT
Name 8-Cyano-6,10-diferrocenyl-3-imino-2-oxopyrano[4,3-d]pyrazolo[1,5-a]pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H22Fe2N4O2
InChI InChI=1S/C21H12N4O2.2C5H5.2Fe/c22-11-15-14-9-18(13-7-3-4-8-13)27-21(26)19(14)20(23)25-17(15)10-16(24-25)12-5-1-2-6-12;2*1-2-4-5-3-1;;/h1-10,23-24H;2*1-5H;;
InChIKey XVMJGRLHKLVIBZ-UHFFFAOYSA-N
Molecular Weight 594.233 g/mol
SMILES N1C(=CC2=C(C=3C=C(OC(C3C(N12)=N)=O)C12[Fe]3456789(C%10C5C7C6C3%10)C1C4C9C28)C#N)C12[Fe]3456789(C1C4C3C29)C1C5C6C7C81
SPLASH splash10-052f-0004090000-47744388915120528642
Source of Spectrum SO-0-815-5
Wiley ID 877745