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3-[1"-Phenyl-5H-[1,2,4]-triazolo[4,3-a](5"-oxo)pyrimidinyl]-3'-[7"-phenyl-5H-[1,2,4-triazolo]-[4,3-a](5"-oxo)pyrimidine
SpectraBase Compound ID 2NP525tnTjn
InChI InChI=1S/C34H22N8O2/c43-29-21-27(23-13-5-1-6-14-23)35-33-39(29)31(37-41(33)25-17-9-3-10-18-25)32-38-42(26-19-11-4-12-20-26)34-36-28(22-30(44)40(32)34)24-15-7-2-8-16-24/h1-22H
InChIKey HXHUIPPOBCONAR-UHFFFAOYSA-N
Mol Weight 574.6 g/mol
Molecular Formula C34H22N8O2
Exact Mass 574.186572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77FWkcV7i2C
Name 3-[1"-Phenyl-5H-[1,2,4]-triazolo[4,3-a](5"-oxo)pyrimidinyl]-3'-[7"-phenyl-5H-[1,2,4-triazolo]-[4,3-a](5"-oxo)pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H22N8O2
InChI InChI=1S/C34H22N8O2/c43-29-21-27(23-13-5-1-6-14-23)35-33-39(29)31(37-41(33)25-17-9-3-10-18-25)32-38-42(26-19-11-4-12-20-26)34-36-28(22-30(44)40(32)34)24-15-7-2-8-16-24/h1-22H
InChIKey HXHUIPPOBCONAR-UHFFFAOYSA-N
Molecular Weight 574.604 g/mol
SMILES C=1(C=2N3C(=NC(=CC3=O)c3ccccc3)N(N2)c2ccccc2)N2C(=NC(=CC2=O)c2ccccc2)N(N1)c1ccccc1
SPLASH splash10-0h36-5976140000-7a5c24fce4ad96d13791
Source of Spectrum AH-132-720-6
Synonyms 3-[1''-Phenyl-5H-[1,2,4]-triazolo[4,3-a](5''-oxo)pyrimidinyl]-3'-[7''-phenyl-5H-[1,2,4-triazolo]-[4,3-a](5''-oxo)pyrimidine
Wiley ID 849891