| SpectraBase Compound ID | C0xNal5QXeH |
|---|---|
| InChI | InChI=1S/C15H26N2OS/c1-18-4-2-3-16-14(19)17-15-8-11-5-12(9-15)7-13(6-11)10-15/h11-13H,2-10H2,1H3,(H2,16,17,19)/t11-,12+,13-,15- |
| InChIKey | JRSYYJULUARCNL-BVMXXOESSA-N |
| Mol Weight | 282.45 g/mol |
| Molecular Formula | C15H26N2OS |
| Exact Mass | 282.176585 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4vENxuIcYEl |
|---|---|
| Name | 1-(Adamantan-1-yl)-3-(3-methoxypropyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.176584638 u |
| Formula | C15H26N2OS |
| InChI | InChI=1S/C15H26N2OS/c1-18-4-2-3-16-14(19)17-15-8-11-5-12(9-15)7-13(6-11)10-15/h11-13H,2-10H2,1H3,(H2,16,17,19)/t11-,12+,13-,15- |
| InChIKey | JRSYYJULUARCNL-BVMXXOESSA-N |
| SMILES | C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])NC(=S)NCCCOC |