![1-Furfuryl-5-[(p-isobutoxyphenyl)sulfonyl]biguanide](/api/spectrum/HPcF4MhUrjc/structure.png?h=300&w=458 "1-Furfuryl-5-[(p-isobutoxyphenyl)sulfonyl]biguanide")
| SpectraBase Compound ID | 208PQZcKSQV |
|---|---|
| InChI | InChI=1S/C17H23N5O4S/c1-12(2)11-26-13-5-7-15(8-6-13)27(23,24)22-17(19)21-16(18)20-10-14-4-3-9-25-14/h3-9,12H,10-11H2,1-2H3,(H5,18,19,20,21,22) |
| InChIKey | DOAIRMIFWMPDQZ-UHFFFAOYSA-N |
| Mol Weight | 393.46 g/mol |
| Molecular Formula | C17H23N5O4S |
| Exact Mass | 393.147075 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HPcF4MhUrjc |
|---|---|
| Name | 1-Furfuryl-5-[(p-isobutoxyphenyl)sulfonyl]biguanide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 393.147075411 u |
| Formula | C17H23N5O4S |
| InChI | InChI=1S/C17H23N5O4S/c1-12(2)11-26-13-5-7-15(8-6-13)27(23,24)22-17(19)21-16(18)20-10-14-4-3-9-25-14/h3-9,12H,10-11H2,1-2H3,(H5,18,19,20,21,22) |
| InChIKey | DOAIRMIFWMPDQZ-UHFFFAOYSA-N |
| Molecular Weight | 393.462 g/mol |
| SMILES | N(CC=1OC=CC1)C(NC(NS(=O)(=O)C=1C=CC(=CC1)OCC(C)C)=N)=N |