| SpectraBase Spectrum ID |
CNBv0wZ46D7 |
| Name |
9-(1,3-benzodioxol-5-yl)-1-(2-benzoxy-6-hydroxy-phenyl)-3-hydroxy-nonan-1-one |
| Alternate Name(s) |
9-(1,3-benzodioxol-5-yl)-1-(2-benzyloxy-6-hydroxy-phenyl)-3-hydroxy-nonan-1-one
9-(1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxy-6-phenylmethoxyphenyl)-1-nonanone
9-(1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxy-6-phenylmethoxyphenyl)nonan-1-one
9-(1,3-benzodioxol-5-yl)-3-oxidanyl-1-(2-oxidanyl-6-phenylmethoxy-phenyl)nonan-1-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H32O6 |
| InChI |
InChI=1S/C29H32O6/c30-23(12-7-2-1-4-9-21-15-16-26-28(17-21)35-20-34-26)18-25(32)29-24(31)13-8-14-27(29)33-19-22-10-5-3-6-11-22/h3,5-6,8,10-11,13-17,23,30-31H,1-2,4,7,9,12,18-20H2 |
| InChIKey |
IKZDTFBKFLAUAL-UHFFFAOYSA-N |
| Molecular Weight |
476.569 g/mol |
| SMILES |
OC(CC(c1c(cccc1OCc1ccccc1)O)=O)CCCCCCc1cc2c(cc1)OCO2 |
| SPLASH |
splash10-0006-9000100000-e973c8ed8a6f35f403f7 |
| Source of Spectrum |
E1-39-21-16 |
| Wiley ID |
1518659 |
