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N,N'-(1,4-Phenylene)bis(2-(2-(2-cyanophenyl)hydrazono)-3-oxo-3-phenylpropa-namide)
SpectraBase Compound ID 7n408My3Snk
InChI InChI=1S/C38H26N8O4/c39-23-27-15-7-9-17-31(27)43-45-33(35(47)25-11-3-1-4-12-25)37(49)41-29-19-21-30(22-20-29)42-38(50)34(36(48)26-13-5-2-6-14-26)46-44-32-18-10-8-16-28(32)24-40/h1-22,43-44H,(H,41,49)(H,42,50)/b45-33+,46-34+
InChIKey PTEWUUYCWIHRME-NCOOAAOESA-N
Mol Weight 658.7 g/mol
Molecular Formula C38H26N8O4
Exact Mass 658.207701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8sWJUYXAcR
Name N,N'-(1,4-Phenylene)bis(2-(2-(2-cyanophenyl)hydrazono)-3-oxo-3-phenylpropa-namide)
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H26N8O4
InChI InChI=1S/C38H26N8O4/c39-23-27-15-7-9-17-31(27)43-45-33(35(47)25-11-3-1-4-12-25)37(49)41-29-19-21-30(22-20-29)42-38(50)34(36(48)26-13-5-2-6-14-26)46-44-32-18-10-8-16-28(32)24-40/h1-22,43-44H,(H,41,49)(H,42,50)/b45-33+,46-34+
InChIKey PTEWUUYCWIHRME-NCOOAAOESA-N
Molecular Weight 658.678 g/mol
SMILES N(C(\C(=N\Nc1c(C#N)cccc1)C(=O)c1ccccc1)=O)c1ccc(NC(\C(=N\Nc2c(C#N)cccc2)C(=O)c2ccccc2)=O)cc1
SPLASH splash10-0a4i-0000009000-e5b3a117f8f498eab36e
Source of Spectrum Y-49-384-3e
Wiley ID 1706550