| SpectraBase Spectrum ID |
4pKJjX8dGpy |
| Name |
2,5-Di-n-hexyl-1,4-benzenedicarboxylic acid |
| Alternate Name(s) |
2,5-dihexylterephthalic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O4 |
| InChI |
InChI=1S/C20H30O4/c1-3-5-7-9-11-15-13-18(20(23)24)16(12-10-8-6-4-2)14-17(15)19(21)22/h13-14H,3-12H2,1-2H3,(H,21,22)(H,23,24) |
| InChIKey |
FWKHOJFYTHYXTL-UHFFFAOYSA-N |
| Molecular Weight |
334.456 g/mol |
| SMILES |
OC(c1cc(c(C(=O)O)cc1CCCCCC)CCCCCC)=O |
| SPLASH |
splash10-03e9-0097000000-b59f63c477f29032e061 |
| Source of Spectrum |
SO-0-387-5 |
| Wiley ID |
1540035 |
