| SpectraBase Spectrum ID |
6JnHcOVPknX |
| Name |
1,2,3-Trimethoxy-5-(pent-4-en-1-ynyl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
232.109944372 u |
| Formula |
C14H16O3 |
| InChI |
InChI=1S/C14H16O3/c1-5-6-7-8-11-9-12(15-2)14(17-4)13(10-11)16-3/h5,9-10H,1,6H2,2-4H3 |
| InChIKey |
ZSZCQPXRSBSGFO-UHFFFAOYSA-N |
| Molecular Weight |
232.279 g/mol |
| SMILES |
C=1(C=C(C#CCC=C)C=C(C1OC)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964117 |
