SpectraBase Spectrum ID |
A7WYSO7I5Ib |
Name |
N,3,4,Trimethyl-1-thia-7-azaspiro[5.4]deca-3,9-diene-7-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
209.087435280 u |
Formula |
C11H15NOS |
InChI |
InChI=1S/C11H15NOS/c1-8-6-11(14-7-9(8)2)5-4-10(13)12(11)3/h4-5H,6-7H2,1-3H3 |
InChIKey |
WESPWPAZIVJZBK-UHFFFAOYSA-N |
Molecular Weight |
209.307 g/mol |
SMILES |
C12(N(C(=O)C=C2)C)SCC(=C(C1)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.8345 |