SpectraBase Compound ID | Cq2iBbvdiVe |
---|---|
InChI | InChI=1S/C8H18OS/c1-3-5-7-10-8-6-9-4-2/h3-8H2,1-2H3 |
InChIKey | JNEDIXTZHKYKQT-UHFFFAOYSA-N |
Mol Weight | 162.29 g/mol |
Molecular Formula | C8H18OS |
Exact Mass | 162.107836 g/mol |
SpectraBase Spectrum ID | FUcn9sXiLjM |
---|---|
Name | 1-(Butylsulfanyl)-2-ethoxyethane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 162.107836373 u |
Formula | C8H18OS |
InChI | InChI=1S/C8H18OS/c1-3-5-7-10-8-6-9-4-2/h3-8H2,1-2H3 |
InChIKey | JNEDIXTZHKYKQT-UHFFFAOYSA-N |
Molecular Weight | 162.291 g/mol |
SMILES | CCCCSCCOCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981629 |