SpectraBase Spectrum ID |
GxGZ6jDz7wJ |
Name |
Isophthalic acid, 2-ethylphenyl heptyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
368.198759378 u |
Formula |
C23H28O4 |
InChI |
InChI=1S/C23H28O4/c1-3-5-6-7-10-16-26-22(24)19-13-11-14-20(17-19)23(25)27-21-15-9-8-12-18(21)4-2/h8-9,11-15,17H,3-7,10,16H2,1-2H3 |
InChIKey |
MKCKAFLMSWMCNQ-UHFFFAOYSA-N |
Molecular Weight |
368.473 g/mol |
SMILES |
C1=CC(=CC(=C1)C(=O)OCCCCCCC)C(OC1=C(CC)C=CC=C1)=O |