SpectraBase Spectrum ID |
1wgDASgtk4E |
Name |
2-[3-(4-Methoxyphenyl)propyl]oxolane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
220.146329882 u |
Formula |
C14H20O2 |
InChI |
InChI=1S/C14H20O2/c1-15-13-9-7-12(8-10-13)4-2-5-14-6-3-11-16-14/h7-10,14H,2-6,11H2,1H3 |
InChIKey |
CVFQZEPBRHPQCO-UHFFFAOYSA-N |
Molecular Weight |
220.312 g/mol |
SMILES |
C1(OCCC1)CCCC=1C=CC(=CC1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935182 |