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N-(1-adamantylmethyl)-2-[4-bromo-5-cyclopropyl-3-(difluoromethyl)-1H-pyrazol-1-yl]acetamide
SpectraBase Compound ID 36PYBMJDFM3
InChI InChI=1S/C20H26BrF2N3O/c21-16-17(19(22)23)25-26(18(16)14-1-2-14)9-15(27)24-10-20-6-11-3-12(7-20)5-13(4-11)8-20/h11-14,19H,1-10H2,(H,24,27)/t11-,12+,13-,20-
InChIKey DGYRBXLSHAQJGX-LOXOZFHKSA-N
Mol Weight 442.35 g/mol
Molecular Formula C20H26BrF2N3O
Exact Mass 441.122732 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5jL3FjM382L
Name N-(1-adamantylmethyl)-2-[4-bromo-5-cyclopropyl-3-(difluoromethyl)-1H-pyrazol-1-yl]acetamide
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/C20H26BrF2N3O/c21-16-17(19(22)23)25-26(18(16)14-1-2-14)9-15(27)24-10-20-6-11-3-12(7-20)5-13(4-11)8-20/h11-14,19H,1-10H2,(H,24,27)/t11-,12+,13-,20-
InChIKey DGYRBXLSHAQJGX-LOXOZFHKSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_29970
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: 1442582; SBI_ID: SBI-029974
Temperature 306 °C