SpectraBase Spectrum ID |
1A76YQ47aQx |
Name |
4-[3-(1-Methoxy-1-methyl-ethoxy)cyclopenten-1-yl]butan-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
228.172544630 u |
Formula |
C13H24O3 |
InChI |
InChI=1S/C13H24O3/c1-13(2,15-3)16-12-8-7-11(10-12)6-4-5-9-14/h10,12,14H,4-9H2,1-3H3 |
InChIKey |
IGDUREXLWLYOKB-UHFFFAOYSA-N |
Molecular Weight |
228.332 g/mol |
SMILES |
C1=C(CCC1OC(OC)(C)C)CCCCO |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959507 |