| SpectraBase Spectrum ID |
GWuE7eCb6UM |
| Name |
ethanaminium, 2-[(5-heptyl-1,6-dihydro-4-hydroxy-6-oxo-1-phenyl-2-pyrimidinyl)thio]-N,N-dimethyl-, chloride |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
425.190376154 u |
| Formula |
C21H32ClN3O2S |
| InChI |
InChI=1S/C21H31N3O2S.ClH/c1-4-5-6-7-11-14-18-19(25)22-21(27-16-15-23(2)3)24(20(18)26)17-12-9-8-10-13-17;/h8-10,12-13,25H,4-7,11,14-16H2,1-3H3;1H |
| InChIKey |
ZPTQRMBBJQQPHG-UHFFFAOYSA-N |
| Molecular Weight |
426.019 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_12813 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/10021777; Lab Info: PLU; Lab Number: FCI-427-0059 |
![ethanaminium, 2-[(5-heptyl-1,6-dihydro-4-hydroxy-6-oxo-1-phenyl-2-pyrimidinyl)thio]-N,N-dimethyl-, chloride](/api/spectrum/GWuE7eCb6UM/structure.png?h=300&w=458 "ethanaminium, 2-[(5-heptyl-1,6-dihydro-4-hydroxy-6-oxo-1-phenyl-2-pyrimidinyl)thio]-N,N-dimethyl-, chloride")
