| SpectraBase Spectrum ID |
IkJf651HUFU |
| Name |
Variabilin, methyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.115423675 u |
| Formula |
C18H18O5 |
| InChI |
InChI=1S/C18H18O5/c1-19-11-4-6-13-15(8-11)22-10-18(21-3)14-7-5-12(20-2)9-16(14)23-17(13)18/h4-9,17H,10H2,1-3H3/t17-,18+/m1/s1 |
| InChIKey |
RMFXUKOXDVZLPA-MSOLQXFVSA-N |
| Molecular Weight |
314.337 g/mol |
| SMILES |
C1=C(C=C2C(=C1)[C@]1(OC3=C([C@]1(CO2)OC)C=CC(=C3)OC)[H])OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9586 |
