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N-(1-adamantyl)-4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinecarboxamide

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N-(1-adamantyl)-4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinecarboxamide
SpectraBase Compound ID 62x0iOwnB3a
InChI InChI=1S/C23H31N3O3/c27-22(24-23-11-17-7-18(12-23)9-19(8-17)13-23)26-5-3-25(4-6-26)14-16-1-2-20-21(10-16)29-15-28-20/h1-2,10,17-19H,3-9,11-15H2,(H,24,27)/t17-,18+,19-,23-
InChIKey BOULBCLXKBABCG-CDIPDJBESA-N
Mol Weight 397.52 g/mol
Molecular Formula C23H31N3O3
Exact Mass 397.236542 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ate9nMplpGl
Name N-(1-adamantyl)-4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinecarboxamide
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/C23H31N3O3/c27-22(24-23-11-17-7-18(12-23)9-19(8-17)13-23)26-5-3-25(4-6-26)14-16-1-2-20-21(10-16)29-15-28-20/h1-2,10,17-19H,3-9,11-15H2,(H,24,27)/t17-,18+,19-,23-
InChIKey BOULBCLXKBABCG-CDIPDJBESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_21003
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/9328629; UBI_ID: UBI-021007
Temperature 318 °C