| SpectraBase Spectrum ID |
FdzE8u3sQao |
| Name |
Sebacic acid, 2,6-dimethoxyphenyl isobutyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.235538809 u |
| Formula |
C22H34O6 |
| InChI |
InChI=1S/C22H34O6/c1-17(2)16-27-20(23)14-9-7-5-6-8-10-15-21(24)28-22-18(25-3)12-11-13-19(22)26-4/h11-13,17H,5-10,14-16H2,1-4H3 |
| InChIKey |
TUWPXKBCVGBSMR-UHFFFAOYSA-N |
| Molecular Weight |
394.508 g/mol |
| SMILES |
C(CCCCC(OC1=C(OC)C=CC=C1OC)=O)CCCC(OCC(C)C)=O |
