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6-(1-adamantyl)-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2(1H)-pyrimidinethione

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6-(1-adamantyl)-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2(1H)-pyrimidinethione
SpectraBase Compound ID 1uqHqDdr6rN
InChI InChI=1S/C23H30N2O3S/c1-26-18-7-16(8-19(27-2)21(18)28-3)17-9-20(25-22(29)24-17)23-10-13-4-14(11-23)6-15(5-13)12-23/h7-9,13-15,17H,4-6,10-12H2,1-3H3,(H2,24,25,29)/t13-,14+,15-,17?,23-
InChIKey NBKOLADYUCUELK-SFFPRKFTSA-N
Mol Weight 414.56 g/mol
Molecular Formula C23H30N2O3S
Exact Mass 414.197714 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8yvD6J7gkve
Name 6-(1-adamantyl)-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2(1H)-pyrimidinethione
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/C23H30N2O3S/c1-26-18-7-16(8-19(27-2)21(18)28-3)17-9-20(25-22(29)24-17)23-10-13-4-14(11-23)6-15(5-13)12-23/h7-9,13-15,17H,4-6,10-12H2,1-3H3,(H2,24,25,29)/t13-,14+,15-,17?,23-
InChIKey NBKOLADYUCUELK-SFFPRKFTSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8445
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/1268402; Labnumber: DEL0769; UZI_ID: UZI-008447
Temperature 313 °C