| SpectraBase Compound ID | 5FfFnbdWKIu |
|---|---|
| InChI | InChI=1S/C13H15N5OS2/c20-12(14-9-11-7-4-8-19-11)16-18-13(21)17-15-10-5-2-1-3-6-10/h1-8,15H,9H2,(H2,14,16,20)(H2,17,18,21) |
| InChIKey | JBXOSVJDXSHLHX-UHFFFAOYSA-N |
| Mol Weight | 321.42 g/mol |
| Molecular Formula | C13H15N5OS2 |
| Exact Mass | 321.071802 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | H38kqaGY2cP |
|---|---|
| Name | 1-Anilino-2,5-dithio-6-furfurylbiurea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 321.071802470 u |
| Formula | C13H15N5OS2 |
| InChI | InChI=1S/C13H15N5OS2/c20-12(14-9-11-7-4-8-19-11)16-18-13(21)17-15-10-5-2-1-3-6-10/h1-8,15H,9H2,(H2,14,16,20)(H2,17,18,21) |
| InChIKey | JBXOSVJDXSHLHX-UHFFFAOYSA-N |
| Molecular Weight | 321.417 g/mol |
| SMILES | N(C1=CC=CC=C1)NC(NNC(NCC=1OC=CC1)=S)=S |