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1,10-dimethyl-4,7-bis(phenylcarbonyl)-1,10-dihydro-4,7-phenanthroline-3,8-dicarbonitrile

View entire compound with spectra: 1 MS (GC)

1,10-dimethyl-4,7-bis(phenylcarbonyl)-1,10-dihydro-4,7-phenanthroline-3,8-dicarbonitrile
SpectraBase Compound ID 6bvQTuUK5n9
InChI InChI=1S/C30H22N4O2/c1-19-15-23(17-31)33(29(35)21-9-5-3-6-10-21)25-13-14-26-28(27(19)25)20(2)16-24(18-32)34(26)30(36)22-11-7-4-8-12-22/h3-16,19-20H,1-2H3
InChIKey AKBWVIVSZZDEFU-UHFFFAOYSA-N
Mol Weight 470.53 g/mol
Molecular Formula C30H22N4O2
Exact Mass 470.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EkWDjBOK1P0
Name 1,10-dimethyl-4,7-bis(phenylcarbonyl)-1,10-dihydro-4,7-phenanthroline-3,8-dicarbonitrile
Alternate Name(s) 4,7-Dibenzoyl-1,10-dimethyl-1,10-dihydro-4,7-phenanthroline-3,8-dicarbonitrile
CAS Registry Number 76795-65-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H22N4O2
InChI InChI=1S/C30H22N4O2/c1-19-15-23(17-31)33(29(35)21-9-5-3-6-10-21)25-13-14-26-28(27(19)25)20(2)16-24(18-32)34(26)30(36)22-11-7-4-8-12-22/h3-16,19-20H,1-2H3
InChIKey AKBWVIVSZZDEFU-UHFFFAOYSA-N
Molecular Weight 470.532 g/mol
SMILES c12N(C(=CC(c2c2C(C=C(N(c2cc1)C(=O)c1ccccc1)C#N)C)C)C#N)C(=O)c1ccccc1
SPLASH splash10-0a4i-0900100000-96617323b5d05c58925e
Source of Spectrum Y-17-1209-0
Wiley ID 1392939