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N-(1-adamantylmethyl)-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetamide
SpectraBase Compound ID E593QUaQLnO
InChI InChI=1S/C20H29N3O2S/c1-2-3-16-7-17(24)23-19(22-16)26-11-18(25)21-12-20-8-13-4-14(9-20)6-15(5-13)10-20/h7,13-15H,2-6,8-12H2,1H3,(H,21,25)(H,22,23,24)/t13-,14+,15-,20-
InChIKey UASHOOVUVOQKBP-PVGDPBLGSA-N
Mol Weight 375.53 g/mol
Molecular Formula C20H29N3O2S
Exact Mass 375.198048 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID XwBT2yAvtb
Name acetamide, 2-[(4-hydroxy-6-propyl-2-pyrimidinyl)thio]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 375.198048358 u
Formula C20H29N3O2S
InChI InChI=1S/C20H29N3O2S/c1-2-3-16-7-17(24)23-19(22-16)26-11-18(25)21-12-20-8-13-4-14(9-20)6-15(5-13)10-20/h7,13-15H,2-6,8-12H2,1H3,(H,21,25)(H,22,23,24)/t13-,14+,15-,20-
InChIKey UASHOOVUVOQKBP-PVGDPBLGSA-N
Molecular Weight 375.531 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16121
Solvent DMSO-d6
Source Vendor ID: NMR/11220786; Lab Info: KTS; Lab Number: KTS-0103012