SpectraBase Spectrum ID |
1eCPSPUKb0q |
Name |
N-(Adamantan-1-yl)-4,5-dihydro-1,3-thiazol-2-amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
236.134719826 u |
Formula |
C13H20N2S |
InChI |
InChI=1S/C13H20N2S/c1-2-16-12(14-1)15-13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,1-8H2,(H,14,15)/t9-,10+,11-,13- |
InChIKey |
SGVQQJLXHKWNEI-DNSLJTBWSA-N |
Molecular Weight |
236.377 g/mol |
SMILES |
[C@]12(C[C@@]3(C[C@](C2)(CC(C1)(NC1=NCCS1)C3)[H])[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.81353 |