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2,5,7,7-Tetraphenyl-3,4-diazabicyclo[4.1.0]hepta-2,4-diene
SpectraBase Compound ID JpNfGlRCOgx
InChI InChI=1S/C29H22N2/c1-5-13-21(14-6-1)27-25-26(28(31-30-27)22-15-7-2-8-16-22)29(25,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25-26H
InChIKey KUCKZHACFQGZHM-UHFFFAOYSA-N
Mol Weight 398.51 g/mol
Molecular Formula C29H22N2
Exact Mass 398.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68t3lerX4JA
Name 2,5,7,7-Tetraphenyl-3,4-diazabicyclo[4.1.0]hepta-2,4-diene
CAS Registry Number 57694-78-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H22N2
InChI InChI=1S/C29H22N2/c1-5-13-21(14-6-1)27-25-26(28(31-30-27)22-15-7-2-8-16-22)29(25,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25-26H
InChIKey KUCKZHACFQGZHM-UHFFFAOYSA-N
Molecular Weight 398.509 g/mol
SMILES C1(C2C(=NN=C(C12)c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
SPLASH splash10-0002-0396000000-8032be4c210c53f2e632
Source of Spectrum J-41-1248-0
Wiley ID 1368826