SpectraBase Compound ID | 1A6XcJlgdBN |
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InChI | InChI=1S/C24H46O5/c1-3-5-7-9-10-11-12-13-14-15-16-18-20-29-24(26)22-27-21-23(25)28-19-17-8-6-4-2/h3-22H2,1-2H3 |
InChIKey | ZKGZEBTVZMBKPC-UHFFFAOYSA-N |
Mol Weight | 414.6 g/mol |
Molecular Formula | C24H46O5 |
Exact Mass | 414.334525 g/mol |
SpectraBase Spectrum ID | HlvnrLvzPiL |
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Name | Diglycolic acid, hexyl tetradecyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 414.334524576 u |
Formula | C24H46O5 |
InChI | InChI=1S/C24H46O5/c1-3-5-7-9-10-11-12-13-14-15-16-18-20-29-24(26)22-27-21-23(25)28-19-17-8-6-4-2/h3-22H2,1-2H3 |
InChIKey | ZKGZEBTVZMBKPC-UHFFFAOYSA-N |
Molecular Weight | 414.627 g/mol |
SMILES | C(COCC(=O)OCCCCCCCCCCCCCC)(=O)OCCCCCC |