| SpectraBase Spectrum ID |
LlUBiXxgHRk |
| Name |
5-Allyl-1,5-dimethyl-6-methoxymethylene-1-cyclohexene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
192.151415263 u |
| Formula |
C13H20O |
| InChI |
InChI=1S/C13H20O/c1-5-8-13(3)9-6-7-11(2)12(13)10-14-4/h5,7,10H,1,6,8-9H2,2-4H3/b12-10- |
| InChIKey |
BACZXEIJNKMZNT-BENRWUELSA-N |
| Molecular Weight |
192.302 g/mol |
| SMILES |
C=1(\C(C(CCC1)(CC=C)C)=C\OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931521 |
