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3-(hexahydro-1H-azepin-1-ylcarbonyl)-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SpectraBase Compound ID 7DQoalcxKcS
InChI InChI=1S/C15H17F3N4O/c1-10-8-12(15(16,17)18)22-13(20-10)11(9-19-22)14(23)21-6-4-2-3-5-7-21/h8-9H,2-7H2,1H3
InChIKey NTXNZZICZGFDND-UHFFFAOYSA-N
Mol Weight 326.32 g/mol
Molecular Formula C15H17F3N4O
Exact Mass 326.135446 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1mqYv7mIyB1
Name 3-(hexahydro-1H-azepin-1-ylcarbonyl)-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]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/C15H17F3N4O/c1-10-8-12(15(16,17)18)22-13(20-10)11(9-19-22)14(23)21-6-4-2-3-5-7-21/h8-9H,2-7H2,1H3
InChIKey NTXNZZICZGFDND-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17695
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/9065678; UBI_ID: UBI-017698
Temperature 308 °C