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 |
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 |