SpectraBase Spectrum ID |
C51A4zS9M0g |
Name |
2-Methoxy-5-[2-(7-methoxy-2H-1,3-benzodioxol-5-yl)ethenyl]phenol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
300.099773610 u |
Formula |
C17H16O5 |
InChI |
InChI=1S/C17H16O5/c1-19-14-6-5-11(7-13(14)18)3-4-12-8-15(20-2)17-16(9-12)21-10-22-17/h3-9,18H,10H2,1-2H3/b4-3+ |
InChIKey |
YTVCXBVFGQEBAL-ONEGZZNKSA-N |
SMILES |
C1=C(C2=C(C=C1\C=C\C1=CC(=C(OC)C=C1)O)OCO2)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971865 |