| SpectraBase Spectrum ID |
HLwV8hKlqbO |
| Name |
Glutaric acid, 3-chlorophenyl 2,4,4-trimethylpentyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.159787045 u |
| Formula |
C19H27ClO4 |
| InChI |
InChI=1S/C19H27ClO4/c1-14(12-19(2,3)4)13-23-17(21)9-6-10-18(22)24-16-8-5-7-15(20)11-16/h5,7-8,11,14H,6,9-10,12-13H2,1-4H3 |
| InChIKey |
MQFXDJFFMYHJKL-UHFFFAOYSA-N |
| Molecular Weight |
354.874 g/mol |
| SMILES |
C(CCC(OC1=CC(=CC=C1)Cl)=O)C(OCC(CC(C)(C)C)C)=O |
