| SpectraBase Spectrum ID |
GLNMn1ZpY3y |
| Name |
2-[(3-octyl-1H-1,2,4-triazol-5-yl)sulfanyl]propanoic 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 |
285.151098165 u |
| Formula |
C13H23N3O2S |
| InChI |
InChI=1S/C13H23N3O2S/c1-3-4-5-6-7-8-9-11-14-13(16-15-11)19-10(2)12(17)18/h10H,3-9H2,1-2H3,(H,17,18)(H,14,15,16) |
| InChIKey |
OTTGZMFFWIHQPC-UHFFFAOYSA-N |
| Molecular Weight |
285.406 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_1824 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12278489 |
![2-[(3-octyl-1H-1,2,4-triazol-5-yl)sulfanyl]propanoic acid](/api/spectrum/GLNMn1ZpY3y/structure.png?h=300&w=458 "2-[(3-octyl-1H-1,2,4-triazol-5-yl)sulfanyl]propanoic acid")
