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[7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-yl-methanone
SpectraBase Compound ID Hjq9FjbHiwF
InChI InChI=1S/C16H13ClF2N4O2S/c17-16(18,19)13-8-10(12-2-1-7-26-12)20-14-9-11(21-23(13)14)15(24)22-3-5-25-6-4-22/h1-2,7-9H,3-6H2
InChIKey WSBVCIVHAYKHKQ-UHFFFAOYSA-N
Mol Weight 398.82 g/mol
Molecular Formula C16H13ClF2N4O2S
Exact Mass 398.041581 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6Wd9j1JhvcP
Name pyrazolo[1,5-a]pyrimidine, 7-(chlorodifluoromethyl)-2-(4-morpholinylcarbonyl)-5-(2-thienyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.041580873 u
Formula C16H13ClF2N4O2S
InChI InChI=1S/C16H13ClF2N4O2S/c17-16(18,19)13-8-10(12-2-1-7-26-12)20-14-9-11(21-23(13)14)15(24)22-3-5-25-6-4-22/h1-2,7-9H,3-6H2
InChIKey WSBVCIVHAYKHKQ-UHFFFAOYSA-N
Molecular Weight 398.816 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18278
Solvent DMSO-d6
Source Vendor ID: NMR/11250879; Lab Info: DAL; Lab Number: DAL-idk0304