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N-[1-(1-adamantyl)ethyl]-2-[(5-ethyl-4-hydroxy-6-methyl-2-pyrimidinyl)sulfanyl]acetamide
SpectraBase Compound ID JrrZrHnNYXB
InChI InChI=1S/C21H31N3O2S/c1-4-17-12(2)22-20(24-19(17)26)27-11-18(25)23-13(3)21-8-14-5-15(9-21)7-16(6-14)10-21/h13-16H,4-11H2,1-3H3,(H,23,25)(H,22,24,26)/t13?,14-,15+,16-,21-
InChIKey BPZPFSWQHJFMIZ-PSMVTJDTSA-N
Mol Weight 389.56 g/mol
Molecular Formula C21H31N3O2S
Exact Mass 389.213698 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8TLy0ktCYSU
Name N-[1-(1-adamantyl)ethyl]-2-[(5-ethyl-4-hydroxy-6-methyl-2-pyrimidinyl)sulfanyl]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/C21H31N3O2S/c1-4-17-12(2)22-20(24-19(17)26)27-11-18(25)23-13(3)21-8-14-5-15(9-21)7-16(6-14)10-21/h13-16H,4-11H2,1-3H3,(H,23,25)(H,22,24,26)/t13?,14-,15+,16-,21-
InChIKey BPZPFSWQHJFMIZ-PSMVTJDTSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3265
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: D09818; Labnumber: NNOBK-5254; SBI_ID: SBI-003267
Temperature 315 °C