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1-(2-adamantyl)-4-(3-methyl-4-nitrobenzoyl)piperazine

View entire compound with spectra: 1 NMR

1-(2-adamantyl)-4-(3-methyl-4-nitrobenzoyl)piperazine
SpectraBase Compound ID 8BKPHuBFCZH
InChI InChI=1S/C22H29N3O3/c1-14-8-17(2-3-20(14)25(27)28)22(26)24-6-4-23(5-7-24)21-18-10-15-9-16(12-18)13-19(21)11-15/h2-3,8,15-16,18-19,21H,4-7,9-13H2,1H3/t15-,16+,18-,19+,21?
InChIKey XRTJKFLTUZVBOQ-KUUVJGEPSA-N
Mol Weight 383.49 g/mol
Molecular Formula C22H29N3O3
Exact Mass 383.220892 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GxGYpmom86S
Name 1-(2-adamantyl)-4-(3-methyl-4-nitrobenzoyl)piperazine
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/C22H29N3O3/c1-14-8-17(2-3-20(14)25(27)28)22(26)24-6-4-23(5-7-24)21-18-10-15-9-16(12-18)13-19(21)11-15/h2-3,8,15-16,18-19,21H,4-7,9-13H2,1H3/t15-,16+,18-,19+,21?
InChIKey XRTJKFLTUZVBOQ-KUUVJGEPSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13230
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/9068000; UBI_ID: UBI-013233
Temperature 308 °C