| SpectraBase Spectrum ID |
3l6j7t9Gu5l |
| Name |
9-(1,3-benzodioxol-5-yl)-1-(2,6-dihydroxyphenyl)-3-hydroxy-1-nonanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26O6 |
| InChI |
InChI=1S/C22H26O6/c23-16(13-19(26)22-17(24)8-5-9-18(22)25)7-4-2-1-3-6-15-10-11-20-21(12-15)28-14-27-20/h5,8-12,16,23-25H,1-4,6-7,13-14H2 |
| InChIKey |
FBNAQZNZDQOMGL-UHFFFAOYSA-N |
| Molecular Weight |
386.444 g/mol |
| SMILES |
OC(CC(c1c(cccc1O)O)=O)CCCCCCc1cc2c(cc1)OCO2 |
| SPLASH |
splash10-000i-0900000000-f578d5df25cfee94a1c9 |
| Source of Spectrum |
E1-39-21-8 |
| Synonyms |
9-(1,3-benzodioxol-5-yl)-1-(2,6-dihydroxyphenyl)-3-hydroxynonan-1-one
9-(1,3-benzodioxol-5-yl)-1-[2,6-bis(oxidanyl)phenyl]-3-oxidanyl-nonan-1-one |
| Wiley ID |
1518657 |
