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2-{3-[(4-isopropylphenoxy)methyl]phenyl}-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
SpectraBase Compound ID SAd9Tvibjs
InChI InChI=1S/C26H24N4OS/c1-16(2)18-9-11-20(12-10-18)31-14-17-5-3-6-19(13-17)24-28-25-23-21-7-4-8-22(21)32-26(23)27-15-30(25)29-24/h3,5-6,9-13,15-16H,4,7-8,14H2,1-2H3
InChIKey HYUMNUQUOYUVME-UHFFFAOYSA-N
Mol Weight 440.57 g/mol
Molecular Formula C26H24N4OS
Exact Mass 440.167083 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7o9xKa81miI
Name 2-{3-[(4-isopropylphenoxy)methyl]phenyl}-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-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/C26H24N4OS/c1-16(2)18-9-11-20(12-10-18)31-14-17-5-3-6-19(13-17)24-28-25-23-21-7-4-8-22(21)32-26(23)27-15-30(25)29-24/h3,5-6,9-13,15-16H,4,7-8,14H2,1-2H3
InChIKey HYUMNUQUOYUVME-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10452
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: UZI/1270013; Labnumber: KMB0593; UZI_ID: UZI-010454
Synonyms 3-(9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)benzyl 4-isopropylphenyl ether
Temperature 313 °C