| SpectraBase Spectrum ID |
5mLoDq85Ym5 |
| Name |
Rosellisin aldehyde |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12O7 |
| InChI |
InChI=1S/C12H12O7/c1-17-10-7(6-14)8(4-3-5-13)19-12(16)9(10)11(15)18-2/h3-4,6,13H,5H2,1-2H3/b4-3+ |
| InChIKey |
BLPAODOYBQUJTO-ONEGZZNKSA-N |
| Molecular Weight |
268.221 g/mol |
| SMILES |
OC\C=C\C=1OC(C(=C(C1C=O)OC)C(=O)OC)=O |
| SPLASH |
splash10-0a4i-0090000000-d8c649ca70fed2c348b2 |
| Source of Spectrum |
E1-42-2616-6 |
| Wiley ID |
1552791 |
