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9-(difluoromethyl)-2-{3-[(2-methoxyphenoxy)methyl]phenyl}-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
SpectraBase Compound ID ISGEpBsEO9s
InChI InChI=1S/C26H19F2N5O2S/c1-14-10-17(23(27)28)30-26-20(14)21-22(36-26)25-31-24(32-33(25)13-29-21)16-7-5-6-15(11-16)12-35-19-9-4-3-8-18(19)34-2/h3-11,13,23H,12H2,1-2H3
InChIKey QKDNBRDZIPWRTN-UHFFFAOYSA-N
Mol Weight 503.53 g/mol
Molecular Formula C26H19F2N5O2S
Exact Mass 503.122752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EJGbX9UScfP
Name 9-(difluoromethyl)-2-{3-[(2-methoxyphenoxy)methyl]phenyl}-7-methylpyrido[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/C26H19F2N5O2S/c1-14-10-17(23(27)28)30-26-20(14)21-22(36-26)25-31-24(32-33(25)13-29-21)16-7-5-6-15(11-16)12-35-19-9-4-3-8-18(19)34-2/h3-11,13,23H,12H2,1-2H3
InChIKey QKDNBRDZIPWRTN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33202
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: 1912199; SBI_ID: SBI-033206
Temperature 318 °C