| SpectraBase Spectrum ID |
BCZQXhfSZyr |
| Name |
4-(methylsulfanyl)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanoic acid |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
265.077264518 u |
| Formula |
C13H15NO3S |
| InChI |
InChI=1S/C13H15NO3S/c1-18-7-6-11(13(16)17)14-8-9-4-2-3-5-10(9)12(14)15/h2-5,11H,6-8H2,1H3,(H,16,17) |
| InChIKey |
IQXRWPVUENIJCR-UHFFFAOYSA-N |
| Molecular Weight |
265.327 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_8898 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12669250 |
| Temperature |
29.85 °C |
