| SpectraBase Spectrum ID |
Uxb6GmwZFy |
| Name |
5-(3'-Hydroxy-4'-methoxyphenyl-2-methoxy-1,4-benzoquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.068473481 u |
| Formula |
C14H12O5 |
| InChI |
InChI=1S/C14H12O5/c1-18-13-4-3-8(5-11(13)16)9-6-12(17)14(19-2)7-10(9)15/h3-7,16H,1-2H3 |
| InChIKey |
ZPQWHRDLHMQISN-UHFFFAOYSA-N |
| Molecular Weight |
260.245 g/mol |
| SMILES |
C1(=CC(=O)C(=CC1=O)OC)C=1C=C(O)C(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9291 |
