SpectraBase Spectrum ID |
2odnw9TokHo |
Name |
Carbamothioic acid, dimethyl-, S-2-octenyl ester, (Z)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
215.134385473 u |
Formula |
C11H21NOS |
InChI |
InChI=1S/C11H21NOS/c1-4-5-6-7-8-9-10-14-11(13)12(2)3/h8-9H,4-7,10H2,1-3H3/b9-8- |
InChIKey |
ZAQIAFGKSIDXET-HJWRWDBZSA-N |
Molecular Weight |
215.355 g/mol |
SMILES |
C(N(C)C)(=O)SC\C=C/CCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959632 |