| SpectraBase Spectrum ID |
D3SvjSPuDWv |
| Name |
1-(Adamantan-1-yl)-3-(prop-2-en-1-yl)thiourea |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.150369890 u |
| Formula |
C14H22N2S |
| InChI |
InChI=1S/C14H22N2S/c1-2-3-15-13(17)16-14-7-10-4-11(8-14)6-12(5-10)9-14/h2,10-12H,1,3-9H2,(H2,15,16,17)/t10-,11+,12-,14- |
| InChIKey |
HLNJIDTYNQWAPT-XDCQQTESSA-N |
| Molecular Weight |
250.404 g/mol |
| SMILES |
C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])NC(=S)NCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.859284 |
