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ethyl 4-{[7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}-1-piperazinecarboxylate
SpectraBase Compound ID A8V0E7AtYQt
InChI InChI=1S/C22H23F2N5O4/c1-3-33-22(31)28-10-8-27(9-11-28)21(30)16-13-25-29-18(19(23)24)12-17(26-20(16)29)14-4-6-15(32-2)7-5-14/h4-7,12-13,19H,3,8-11H2,1-2H3
InChIKey XDULGASYROSUPO-UHFFFAOYSA-N
Mol Weight 459.45 g/mol
Molecular Formula C22H23F2N5O4
Exact Mass 459.171811 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FQF3kuxKWKM
Name ethyl 4-{[7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}-1-piperazinecarboxylate
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/C22H23F2N5O4/c1-3-33-22(31)28-10-8-27(9-11-28)21(30)16-13-25-29-18(19(23)24)12-17(26-20(16)29)14-4-6-15(32-2)7-5-14/h4-7,12-13,19H,3,8-11H2,1-2H3
InChIKey XDULGASYROSUPO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9907
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/9318483; Labnumber: IRA1299; UZI_ID: UZI-009909
Temperature 308 °C