![1-Ethyl-3-[2-(1H-imidazol-5-yl)ethyl]thiourea](/api/spectrum/CYdBuSnGprD/structure.png?h=300&w=458 "1-Ethyl-3-[2-(1H-imidazol-5-yl)ethyl]thiourea")
| SpectraBase Compound ID | DUwUGUCEH33 |
|---|---|
| InChI | InChI=1S/C8H14N4S/c1-2-10-8(13)11-4-3-7-5-9-6-12-7/h5-6H,2-4H2,1H3,(H,9,12)(H2,10,11,13) |
| InChIKey | SJGKVZDIDVBOJC-UHFFFAOYSA-N |
| Mol Weight | 198.29 g/mol |
| Molecular Formula | C8H14N4S |
| Exact Mass | 198.093918 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CYdBuSnGprD |
|---|---|
| Name | 1-Ethyl-3-[2-(1H-imidazol-5-yl)ethyl]thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.093917641 u |
| Formula | C8H14N4S |
| InChI | InChI=1S/C8H14N4S/c1-2-10-8(13)11-4-3-7-5-9-6-12-7/h5-6H,2-4H2,1H3,(H,9,12)(H2,10,11,13) |
| InChIKey | SJGKVZDIDVBOJC-UHFFFAOYSA-N |
| Molecular Weight | 198.288 g/mol |
| SMILES | C=1(N=CNC1)CCNC(=S)NCC |