| SpectraBase Spectrum ID |
489kDAcrUOI |
| Name |
(3,5-Dihydroxy-2-octanoylphenyl)-acetic Acid |
| Alternate Name(s) |
2-[3,5-dihydroxy-2-(1-oxooctyl)phenyl]acetic acid
2-(3,5-dihydroxy-2-octanoylphenyl)acetic acid
2-(3,5-dihydroxy-2-octanoyl-phenyl)acetic acid
2-[2-octanoyl-3,5-bis(oxidanyl)phenyl]ethanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O5 |
| InChI |
InChI=1S/C16H22O5/c1-2-3-4-5-6-7-13(18)16-11(9-15(20)21)8-12(17)10-14(16)19/h8,10,17,19H,2-7,9H2,1H3,(H,20,21) |
| InChIKey |
NBOKSRGCFZKGBA-UHFFFAOYSA-N |
| Molecular Weight |
294.347 g/mol |
| SMILES |
Oc1cc(c(c(c1)O)C(CCCCCCC)=O)CC(=O)O |
| SPLASH |
splash10-0ldi-0930000000-989b7cbbe0f586ba980a |
| Source of Spectrum |
X4-21-364-0 |
| Wiley ID |
1585804 |
