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5,5-Diphenyl-3-[(2''-tetrazol-5''-yl)biphenyl-4'-yl]-methylhydantoin
SpectraBase Compound ID EB8qkWMAd7b
InChI InChI=1S/C29H22N6O2/c36-27-29(22-12-6-2-7-13-22,23-14-8-3-9-15-23)30-28(37)35(27)19-20-16-17-24(21-10-4-1-5-11-21)25(18-20)26-31-33-34-32-26/h1-18H,19H2,(H,30,37)(H,31,32,33,34)
InChIKey ZGIWLVACMOFFCU-UHFFFAOYSA-N
Mol Weight 486.54 g/mol
Molecular Formula C29H22N6O2
Exact Mass 486.180424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5bJ2f0vqq
Name 5,5-Diphenyl-3-[(2''-tetrazol-5''-yl)biphenyl-4'-yl]-methylhydantoin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H22N6O2
InChI InChI=1S/C29H22N6O2/c36-27-29(22-12-6-2-7-13-22,23-14-8-3-9-15-23)30-28(37)35(27)19-20-16-17-24(21-10-4-1-5-11-21)25(18-20)26-31-33-34-32-26/h1-18H,19H2,(H,30,37)(H,31,32,33,34)
InChIKey ZGIWLVACMOFFCU-UHFFFAOYSA-N
Molecular Weight 486.535 g/mol
SMILES N1C(C(N(Cc2cc(-c3nnn[nH]3)c(cc2)-c2ccccc2)C1=O)=O)(c1ccccc1)c1ccccc1
SPLASH splash10-004i-3940000000-c6d339c4f89bcfb6259a
Source of Spectrum D9-334-368-4
Synonyms 5,5-Diphenyl-3-{[2-(1H-tetraazol-5-yl)[1,1'-biphenyl]-4-yl]methyl}-2,4-imidazolidinedione
Wiley ID 1550823