| SpectraBase Spectrum ID |
7ncSipHn8vW |
| Name |
9-(1,3-benzodioxol-5-yl)-1-(2-methoxy-6-oxidanyl-phenyl)-3-oxidanyl-nonan-1-one |
| Alternate Name(s) |
9-(1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxy-6-methoxy-phenyl)nonan-1-one
9-(1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxy-6-methoxyphenyl)-1-nonanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H28O6 |
| InChI |
InChI=1S/C23H28O6/c1-27-21-10-6-9-18(25)23(21)19(26)14-17(24)8-5-3-2-4-7-16-11-12-20-22(13-16)29-15-28-20/h6,9-13,17,24-25H,2-5,7-8,14-15H2,1H3 |
| InChIKey |
FOIXTRPHNUCCCX-UHFFFAOYSA-N |
| Molecular Weight |
400.471 g/mol |
| SMILES |
OC(CC(c1c(cccc1OC)O)=O)CCCCCCc1cc2c(cc1)OCO2 |
| SPLASH |
splash10-000i-0900200000-0da8215b2b5f7f1c11ec |
| Source of Spectrum |
E1-39-21-16 |
| Wiley ID |
1518658 |
