![1-benzyl-5-{[p-(octyloxy)phenyl]sulfonyl}biguanide](/api/spectrum/61yLiMxBDJF/structure.png?h=300&w=458 "1-benzyl-5-{[p-(octyloxy)phenyl]sulfonyl}biguanide")
| SpectraBase Compound ID | 9sOMccqvcPS |
|---|---|
| InChI | InChI=1S/C23H33N5O3S/c1-2-3-4-5-6-10-17-31-20-13-15-21(16-14-20)32(29,30)28-23(25)27-22(24)26-18-19-11-8-7-9-12-19/h7-9,11-16H,2-6,10,17-18H2,1H3,(H5,24,25,26,27,28) |
| InChIKey | VYGZSXCJTMEMQO-UHFFFAOYSA-N |
| Mol Weight | 459.6 g/mol |
| Molecular Formula | C23H33N5O3S |
| Exact Mass | 459.230411 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 61yLiMxBDJF |
|---|---|
| Name | 1-benzyl-5-{[p-(octyloxy)phenyl]sulfonyl}biguanide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H33N5O3S |
| InChI | InChI=1S/C23H33N5O3S/c1-2-3-4-5-6-10-17-31-20-13-15-21(16-14-20)32(29,30)28-23(25)27-22(24)26-18-19-11-8-7-9-12-19/h7-9,11-16H,2-6,10,17-18H2,1H3,(H5,24,25,26,27,28) |
| InChIKey | VYGZSXCJTMEMQO-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 9109M |
| Sadtler Reference Number | 8989 |
| Solvent | DMSO-d6 |