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2-[(2-isopropyl-5-methylphenoxy)methyl]-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
SpectraBase Compound ID HmBZfnDwgZy
InChI InChI=1S/C23H22N6O/c1-15(2)18-10-9-16(3)11-20(18)30-13-21-26-23-19-12-25-29(17-7-5-4-6-8-17)22(19)24-14-28(23)27-21/h4-12,14-15H,13H2,1-3H3
InChIKey HWUAXDKUCHEWQP-UHFFFAOYSA-N
Mol Weight 398.47 g/mol
Molecular Formula C23H22N6O
Exact Mass 398.185509 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ITLJG2NkvQV
Name 2-[(2-isopropyl-5-methylphenoxy)methyl]-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H22N6O/c1-15(2)18-10-9-16(3)11-20(18)30-13-21-26-23-19-12-25-29(17-7-5-4-6-8-17)22(19)24-14-28(23)27-21/h4-12,14-15H,13H2,1-3H3
InChIKey HWUAXDKUCHEWQP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17979
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D31535; Labnumber: RRMEZ-1161; SBI_ID: SBI-017982
Synonyms 2-isopropyl-5-methylphenyl (7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl ether
Temperature 318 °C