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3-(1-adamantyl)-1-(3-bromophenyl)-1H-pyrazole-4-carbaldehyde

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(1-adamantyl)-1-(3-bromophenyl)-1H-pyrazole-4-carbaldehyde
SpectraBase Compound ID 6M08K91GeEG
InChI InChI=1S/C20H21BrN2O/c21-17-2-1-3-18(7-17)23-11-16(12-24)19(22-23)20-8-13-4-14(9-20)6-15(5-13)10-20/h1-3,7,11-15H,4-6,8-10H2/t13-,14+,15-,20-
InChIKey VXCIEJRDQFFHPB-PVGDPBLGSA-N
Mol Weight 385.31 g/mol
Molecular Formula C20H21BrN2O
Exact Mass 384.083726 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D00xmsOkNBY
Name 3-(1-adamantyl)-1-(3-bromophenyl)-1H-pyrazole-4-carbaldehyde
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/C20H21BrN2O/c21-17-2-1-3-18(7-17)23-11-16(12-24)19(22-23)20-8-13-4-14(9-20)6-15(5-13)10-20/h1-3,7,11-15H,4-6,8-10H2/t13-,14+,15-,20-
InChIKey VXCIEJRDQFFHPB-PVGDPBLGSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34634
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: 9120486; SBI_ID: SBI-034638
Temperature 308 °C