SpectraBase Compound ID | ROuZETbCWE |
---|---|
InChI | InChI=1S/C9H18O4/c1-3-4-5-13-9(10)8-12-7-6-11-2/h3-8H2,1-2H3 |
InChIKey | BELUYVNKSHWIJR-UHFFFAOYSA-N |
Mol Weight | 190.24 g/mol |
Molecular Formula | C9H18O4 |
Exact Mass | 190.120509 g/mol |
SpectraBase Spectrum ID | LPKDN2QeSNh |
---|---|
Name | Butyl 2-(2-methoxyethoxy)acetate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 190.120509056 u |
Formula | C9H18O4 |
InChI | InChI=1S/C9H18O4/c1-3-4-5-13-9(10)8-12-7-6-11-2/h3-8H2,1-2H3 |
InChIKey | BELUYVNKSHWIJR-UHFFFAOYSA-N |
Molecular Weight | 190.239 g/mol |
SMILES | COCCOCC(OCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.986499 |