| SpectraBase Spectrum ID |
3Ag5y1bfvu1 |
| Name |
cis,Trans-4-methyl-1,2-phenylene dibut-2-enoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.104858991 u |
| Formula |
C15H16O4 |
| InChI |
InChI=1S/C15H16O4/c1-4-6-14(16)18-12-9-8-11(3)10-13(12)19-15(17)7-5-2/h4-10H,1-3H3/b6-4-,7-5+ |
| InChIKey |
SXDWDPBAFBJQRO-XGXWUAJZSA-N |
| Molecular Weight |
260.289 g/mol |
| SMILES |
C1(=C(OC(\C=C/C)=O)C=CC(=C1)C)OC(\C=C\C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958608 |
