SpectraBase Spectrum ID |
JU5kKfZGDpr |
Name |
Methyl-[2-(4-ethoxy-2,3,3-trimethylcyclopent-1-enyl)-ethyl]-ether |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
212.177630011 u |
Formula |
C13H24O2 |
InChI |
InChI=1S/C13H24O2/c1-6-15-12-9-11(7-8-14-5)10(2)13(12,3)4/h12H,6-9H2,1-5H3 |
InChIKey |
GCXQPEICVKPSIJ-UHFFFAOYSA-N |
Molecular Weight |
212.333 g/mol |
SMILES |
C1(OCC)CC(=C(C1(C)C)C)CCOC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975499 |