| SpectraBase Spectrum ID |
FqJD0YRNReR |
| Name |
E-6-Phenyl-1(E)-methoxy-1,6-heptadiene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
202.135765199 u |
| Formula |
C14H18O |
| InChI |
InChI=1S/C14H18O/c1-13(9-5-4-8-12-15-2)14-10-6-3-7-11-14/h3,6-8,10-12H,1,4-5,9H2,2H3/b12-8+ |
| InChIKey |
GDXIXYRBRAHOHQ-XYOKQWHBSA-N |
| Molecular Weight |
202.297 g/mol |
| SMILES |
C(C=1C=CC=CC1)(=C)CCC\C=C\OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974587 |
