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5-(2'-Nitro-1'-phenylethylidene)-1,3,4-triphenyl-4,5-dihydro-1H-1,2,4-triazol
SpectraBase Compound ID CmTv9cUZTcH
InChI InChI=1S/C28H22N4O2/c33-30(34)21-26(22-13-5-1-6-14-22)28-31(24-17-9-3-10-18-24)27(23-15-7-2-8-16-23)29-32(28)25-19-11-4-12-20-25/h1-20H,21H2/b28-26-
InChIKey GDAGBMGUAPMJNP-SGEDCAFJSA-N
Mol Weight 446.51 g/mol
Molecular Formula C28H22N4O2
Exact Mass 446.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mLdJB0ZBw
Name 5-(2'-Nitro-1'-phenylethylidene)-1,3,4-triphenyl-4,5-dihydro-1H-1,2,4-triazol
Alternate Name(s) (5E)-5-(2-nitro-1-phenylethylidene)-1,3,4-triphenyl-4,5-dihydro-1H-1,2,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H22N4O2
InChI InChI=1S/C28H22N4O2/c33-30(34)21-26(22-13-5-1-6-14-22)28-31(24-17-9-3-10-18-24)27(23-15-7-2-8-16-23)29-32(28)25-19-11-4-12-20-25/h1-20H,21H2/b28-26-
InChIKey GDAGBMGUAPMJNP-SGEDCAFJSA-N
Molecular Weight 446.510 g/mol
SMILES C=1(N(\C(N(N1)c1ccccc1)=C/(CN(=O)=O)c1ccccc1)c1ccccc1)c1ccccc1
SPLASH splash10-0036-9400000000-413017d5d8c206669d3d
Source of Spectrum U-1996-2025-11
Wiley ID 769124