| SpectraBase Spectrum ID |
S5Sv0HisnZ |
| Name |
Glutaric acid, dec-2-yl 2,3,5-trichlorophenyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
450.113142510 u |
| Formula |
C21H29Cl3O4 |
| InChI |
InChI=1S/C21H29Cl3O4/c1-3-4-5-6-7-8-10-15(2)27-19(25)11-9-12-20(26)28-18-14-16(22)13-17(23)21(18)24/h13-15H,3-12H2,1-2H3 |
| InChIKey |
YKYLONQHIXTJCW-UHFFFAOYSA-N |
| Molecular Weight |
451.818 g/mol |
| SMILES |
C(CCC(OC(C)CCCCCCCC)=O)C(OC1=C(C(=CC(=C1)Cl)Cl)Cl)=O |
