| SpectraBase Spectrum ID |
21uHtACOJSi |
| Name |
3-(hydroxymethyl)-6,8-dimethoxy-1-benzopyran-2-one |
| Alternate Name(s) |
3-(hydroxymethyl)-6,8-dimethoxy-chromen-2-one
6,8-dimethoxy-3-methylol-coumarin |
| CAS Registry Number |
130838-24-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12O5 |
| InChI |
InChI=1S/C12H12O5/c1-15-9-4-7-3-8(6-13)12(14)17-11(7)10(5-9)16-2/h3-5,13H,6H2,1-2H3 |
| InChIKey |
VEUJKFCQTBOEQL-UHFFFAOYSA-N |
| Molecular Weight |
236.223 g/mol |
| SMILES |
OCC=1C(Oc2c(C1)cc(cc2OC)OC)=O |
| SPLASH |
splash10-000i-0090000000-6213c60601abcea9b798 |
| Source of Spectrum |
I-68-2093-10 |
| Wiley ID |
1237822 |
