SpectraBase Spectrum ID |
HQbK1a9U0WO |
Name |
Propanol, [(butoxymethylethoxy)methylethoxy]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
248.198759378 u |
Formula |
C13H28O4 |
InChI |
InChI=1S/C13H28O4/c1-5-6-7-15-9-12(3)17-10-13(4)16-8-11(2)14/h11-14H,5-10H2,1-4H3 |
InChIKey |
LORVPHHKJFSORQ-UHFFFAOYSA-N |
Molecular Weight |
248.363 g/mol |
SMILES |
CCCCOCC(OCC(OCC(O)C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.989195 |