SpectraBase Spectrum ID |
LU5scccWh4D |
Name |
Glutaric acid, non-5-yn-3-yl pentadecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
464.386560150 u |
Formula |
C29H52O4 |
InChI |
InChI=1S/C29H52O4/c1-4-7-9-11-12-13-14-15-16-17-18-19-21-26-32-28(30)24-22-25-29(31)33-27(6-3)23-20-10-8-5-2/h27H,4-9,11-19,21-26H2,1-3H3 |
InChIKey |
QSFGRWNTBAWJGR-UHFFFAOYSA-N |
Molecular Weight |
464.731 g/mol |
SMILES |
C(C#CCC(OC(CCCC(OCCCCCCCCCCCCCCC)=O)=O)CC)CC |