SpectraBase Spectrum ID |
26mmatYPyD |
Name |
Thiourea, 1-(adamantane-1-carbonyl)-3-cyclohexyl- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
320.192234703 u |
Formula |
C18H28N2OS |
InChI |
InChI=1S/C18H28N2OS/c21-16(20-17(22)19-15-4-2-1-3-5-15)18-9-12-6-13(10-18)8-14(7-12)11-18/h12-15H,1-11H2,(H2,19,20,21,22)/t12-,13+,14-,18- |
InChIKey |
JZRDYHDBBVXOCR-WXZYKRPKSA-N |
Molecular Weight |
320.495 g/mol |
SMILES |
C12(C(NC(NC3CCCCC3)=S)=O)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H] |