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2-{3-[(4-ethoxyphenoxy)methyl]phenyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
SpectraBase Compound ID fbswbxaO0K
InChI InChI=1S/C27H23N5O2S/c1-4-33-20-8-10-21(11-9-20)34-14-18-6-5-7-19(13-18)25-30-26-24-23(28-15-32(26)31-25)22-16(2)12-17(3)29-27(22)35-24/h5-13,15H,4,14H2,1-3H3
InChIKey LTBPFLBBDHBDDR-UHFFFAOYSA-N
Mol Weight 481.57 g/mol
Molecular Formula C27H23N5O2S
Exact Mass 481.157246 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 50rBLMG3SA1
Name 2-{3-[(4-ethoxyphenoxy)methyl]phenyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-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/C27H23N5O2S/c1-4-33-20-8-10-21(11-9-20)34-14-18-6-5-7-19(13-18)25-30-26-24-23(28-15-32(26)31-25)22-16(2)12-17(3)29-27(22)35-24/h5-13,15H,4,14H2,1-3H3
InChIKey LTBPFLBBDHBDDR-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32377
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: 1847617; SBI_ID: SBI-032381
Temperature 306 °C