SpectraBase Compound ID | FRcgRVAV6Tk |
---|---|
InChI | InChI=1S/C15H28O5/c1-3-5-11-18-12-13-20-15(17)9-7-6-8-14(16)19-10-4-2/h3-13H2,1-2H3 |
InChIKey | GRBIVKQRBNHJGH-UHFFFAOYSA-N |
Mol Weight | 288.38 g/mol |
Molecular Formula | C15H28O5 |
Exact Mass | 288.193674 g/mol |
SpectraBase Spectrum ID | KukqCW4sxY2 |
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Name | Adipic acid, 2-butoxyethyl propyl ester |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 288.193673997 u |
Formula | C15H28O5 |
InChI | InChI=1S/C15H28O5/c1-3-5-11-18-12-13-20-15(17)9-7-6-8-14(16)19-10-4-2/h3-13H2,1-2H3 |
InChIKey | GRBIVKQRBNHJGH-UHFFFAOYSA-N |
SMILES | CCCOC(CCCCC(=O)OCCOCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.932008 |