| SpectraBase Spectrum ID |
BQpA1opbc3S |
| Name |
3,5-Cyclohexadiene-1,2-dione, 5-(hydroxymethyl)-3-methoxy- |
| CAS Registry Number |
77745-42-7 |
| Comments |
Removed - expert review: contamination (CHCl3); A corrected record has been addded having SpectrumID: 1821379 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H8O4 |
| InChI |
InChI=1S/C8H8O4/c1-12-7-3-5(4-9)2-6(10)8(7)11/h2-3,9H,4H2,1H3 |
| InChIKey |
VMIUAZMEMYDNAR-UHFFFAOYSA-N |
| Molecular Weight |
168.148 g/mol |
| SMILES |
OCC1=CC(C(C(=C1)OC)=O)=O |
| SPLASH |
splash10-001j-9000000000-fee0a8e0cf0f4a1f87ee |
| Source of Spectrum |
W5-0-0-0 |
| Synonyms |
5-(hydroxymethyl)-3-methoxybenzo-1,2-quinone |
| Wiley ID |
1164108 |
