SpectraBase Spectrum ID |
yuI82bAIYf |
Name |
2,5-Di-n-hexadecyl-1,4-benzenedicarboxylic acid |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C40H70O4 |
InChI |
InChI=1S/C40H70O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-33-38(40(43)44)36(34-37(35)39(41)42)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-34H,3-32H2,1-2H3,(H,41,42)(H,43,44) |
InChIKey |
OSWWLKWLYNJEEB-UHFFFAOYSA-N |
Molecular Weight |
614.996 g/mol |
SMILES |
OC(c1cc(c(C(=O)O)cc1CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)=O |
SPLASH |
splash10-0229-0000098000-967dc19bb2f1e3212387 |
Source of Spectrum |
SO-0-387-5 |
Synonyms |
2,5-dihexadecylterephthalic acid |
Wiley ID |
1540033 |