SpectraBase Spectrum ID |
KHwrh0Dt2u4 |
Name |
Phthalic acid, 4-octyl tetradecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
474.370910086 u |
Formula |
C30H50O4 |
InChI |
InChI=1S/C30H50O4/c1-4-7-9-10-11-12-13-14-15-16-17-20-25-33-29(31)27-23-18-19-24-28(27)30(32)34-26(21-6-3)22-8-5-2/h18-19,23-24,26H,4-17,20-22,25H2,1-3H3 |
InChIKey |
NXWDPLNKZUDHQL-UHFFFAOYSA-N |
Molecular Weight |
474.726 g/mol |
SMILES |
C(CC(OC(C1=C(C(OCCCCCCCCCCCCCC)=O)C=CC=C1)=O)CCC)CC |