| SpectraBase Spectrum ID |
IRq7okqNj8N |
| Name |
benzonitrile, 4-[[(1,4-dihydro-6-methyl-4-oxo-2-pyrimidinyl)thio]methyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
257.062283159 u |
| Formula |
C13H11N3OS |
| InChI |
InChI=1S/C13H11N3OS/c1-9-6-12(17)16-13(15-9)18-8-11-4-2-10(7-14)3-5-11/h2-6H,8H2,1H3,(H,15,16,17) |
| InChIKey |
ABWISZBNOPKFAA-UHFFFAOYSA-N |
| Molecular Weight |
257.311 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8758 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10230759; Lab Info: JSA; Lab Number: JSA-0000202 |
| Temperature |
29.85 °C |
![benzonitrile, 4-[[(1,4-dihydro-6-methyl-4-oxo-2-pyrimidinyl)thio]methyl]-](/api/spectrum/IRq7okqNj8N/structure.png?h=300&w=458 "benzonitrile, 4-[[(1,4-dihydro-6-methyl-4-oxo-2-pyrimidinyl)thio]methyl]-")
