| SpectraBase Spectrum ID |
2mFkx5vUg7L |
| Name |
1-(p-Methoxyphenyl)-3-(alpha-methylphenethyl)-2-thiourea |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.129634445 u |
| Formula |
C17H20N2OS |
| InChI |
InChI=1S/C17H20N2OS/c1-13(12-14-6-4-3-5-7-14)18-17(21)19-15-8-10-16(20-2)11-9-15/h3-11,13H,12H2,1-2H3,(H2,18,19,21) |
| InChIKey |
WQTLWWIBBAFLLP-UHFFFAOYSA-N |
| SMILES |
N(C(CC1=CC=CC=C1)C)C(NC=1C=CC(=CC1)OC)=S |
| Spectrum/Structure Validation Score (Raman) |
0.896545 |
