| SpectraBase Spectrum ID |
asJdA9qqlL |
| Name |
(Z)-1-Methoxy-2-phenyl-2-heptene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.151415263 u |
| Formula |
C14H20O |
| InChI |
InChI=1S/C14H20O/c1-3-4-6-11-14(12-15-2)13-9-7-5-8-10-13/h5,7-11H,3-4,6,12H2,1-2H3/b14-11+ |
| InChIKey |
ALCACXWFIVFMPQ-SDNWHVSQSA-N |
| Molecular Weight |
204.313 g/mol |
| SMILES |
C1(\C(=C\CCCC)COC)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89089 |
