SpectraBase Compound ID | 7P0dX7dKeHI |
---|---|
InChI | InChI=1S/C14H26O4/c1-3-5-7-8-12-18-14(16)10-9-13(15)17-11-6-4-2/h3-12H2,1-2H3 |
InChIKey | GZTGFUZIIWZVFJ-UHFFFAOYSA-N |
Mol Weight | 258.36 g/mol |
Molecular Formula | C14H26O4 |
Exact Mass | 258.183109 g/mol |
SpectraBase Spectrum ID | CIZFwZPCIAj |
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Name | Succinic acid, butyl hexyl ester |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 258.183109313 u |
Formula | C14H26O4 |
InChI | InChI=1S/C14H26O4/c1-3-5-7-8-12-18-14(16)10-9-13(15)17-11-6-4-2/h3-12H2,1-2H3 |
InChIKey | GZTGFUZIIWZVFJ-UHFFFAOYSA-N |
Molecular Weight | 258.358 g/mol |
SMILES | C(OCCCC)(=O)CCC(OCCCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.930111 |