SpectraBase Spectrum ID |
LHSGF3CezMS |
Name |
Naphthalene-2,6-dicarboxylic acid, bis-(4-octyl-phenyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
592.355260022 u |
Formula |
C40H48O4 |
InChI |
InChI=1S/C40H48O4/c1-3-5-7-9-11-13-15-31-17-25-37(26-18-31)43-39(41)35-23-21-34-30-36(24-22-33(34)29-35)40(42)44-38-27-19-32(20-28-38)16-14-12-10-8-6-4-2/h17-30H,3-16H2,1-2H3 |
InChIKey |
KUOIUNUOUCYGTQ-UHFFFAOYSA-N |
Molecular Weight |
592.820 g/mol |
SMILES |
C(CCCCCCC1=CC=C(C=C1)OC(C1=CC2=CC=C(C(=O)OC3=CC=C(C=C3)CCCCCCCC)C=C2C=C1)=O)C |