| SpectraBase Spectrum ID |
DF1V1FB8Wr7 |
| Name |
Glutaric acid, 2-methylpent-3-yl 2,4,4-trimethylpentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.261359635 u |
| Formula |
C19H36O4 |
| InChI |
InChI=1S/C19H36O4/c1-8-16(14(2)3)23-18(21)11-9-10-17(20)22-13-15(4)12-19(5,6)7/h14-16H,8-13H2,1-7H3 |
| InChIKey |
ILRWHECZETUXMO-UHFFFAOYSA-N |
| Molecular Weight |
328.493 g/mol |
| SMILES |
C(CCC(OC(CC)C(C)C)=O)C(OCC(CC(C)(C)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969655 |
