SpectraBase Spectrum ID |
HRUjii2NhJd |
Name |
Glutaric acid, 3-methylbut-2-en-1-yl neopentyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
270.183109313 u |
Formula |
C15H26O4 |
InChI |
InChI=1S/C15H26O4/c1-12(2)9-10-18-13(16)7-6-8-14(17)19-11-15(3,4)5/h9H,6-8,10-11H2,1-5H3 |
InChIKey |
AETOZYXYJQINMH-UHFFFAOYSA-N |
Molecular Weight |
270.369 g/mol |
SMILES |
C(CCC(OCC=C(C)C)=O)C(OCC(C)(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902224 |