| SpectraBase Spectrum ID |
8iqSue51BKn |
| Name |
2-Thiazolamine, 4,5-dihydro-5,5-dimethyl-N-(3-methylphenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.103419697 u |
| Formula |
C12H16N2S |
| InChI |
InChI=1S/C12H16N2S/c1-9-5-4-6-10(7-9)14-11-13-8-12(2,3)15-11/h4-7H,8H2,1-3H3,(H,13,14) |
| InChIKey |
ZDKXTUOZGDPHMI-UHFFFAOYSA-N |
| Molecular Weight |
220.334 g/mol |
| SMILES |
C1=C(C=C(C=C1)NC1=NCC(S1)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.814439 |