| SpectraBase Spectrum ID |
Fr9ebrLAY5h |
| Name |
Glutaric acid, 2-methylpent-3-yl 3-methylbutyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
286.214409442 u |
| Formula |
C16H30O4 |
| InChI |
InChI=1S/C16H30O4/c1-6-14(13(4)5)20-16(18)9-7-8-15(17)19-11-10-12(2)3/h12-14H,6-11H2,1-5H3 |
| InChIKey |
FCTZKYUUWVWHAL-UHFFFAOYSA-N |
| SMILES |
C(CCC(OC(CC)C(C)C)=O)C(OCCC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915592 |
