SpectraBase Compound ID | I1iXvGf89AH |
---|---|
InChI | InChI=1S/C18H30O4/c1-3-5-11-19-13-15-21-17-9-7-8-10-18(17)22-16-14-20-12-6-4-2/h7-10H,3-6,11-16H2,1-2H3 |
InChIKey | ZAVRDIQTJJGXFH-UHFFFAOYSA-N |
Mol Weight | 310.43 g/mol |
Molecular Formula | C18H30O4 |
Exact Mass | 310.214409 g/mol |
SpectraBase Spectrum ID | 2mi5MgJOntJ |
---|---|
Name | 1,2-bis-(2-Butoxy-ethoxy)-benzene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 310.214409442 u |
Formula | C18H30O4 |
InChI | InChI=1S/C18H30O4/c1-3-5-11-19-13-15-21-17-9-7-8-10-18(17)22-16-14-20-12-6-4-2/h7-10H,3-6,11-16H2,1-2H3 |
InChIKey | ZAVRDIQTJJGXFH-UHFFFAOYSA-N |
SMILES | C1(=C(OCCOCCCC)C=CC=C1)OCCOCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.936854 |