SpectraBase Compound ID | GeY20DvV2d3 |
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InChI | InChI=1S/C30H58O4/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-24-28-34-30(32)26-22-21-25-29(31)33-27-23-19-10-8-6-4-2/h3-28H2,1-2H3 |
InChIKey | YZLIPWHEZOWKMM-UHFFFAOYSA-N |
Mol Weight | 482.8 g/mol |
Molecular Formula | C30H58O4 |
Exact Mass | 482.43351 g/mol |
SpectraBase Spectrum ID | BG5LOLgyGOu |
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Name | Adipic acid, hexadecyl octyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 482.433510344 u |
Formula | C30H58O4 |
InChI | InChI=1S/C30H58O4/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-24-28-34-30(32)26-22-21-25-29(31)33-27-23-19-10-8-6-4-2/h3-28H2,1-2H3 |
InChIKey | YZLIPWHEZOWKMM-UHFFFAOYSA-N |
Molecular Weight | 482.790 g/mol |
SMILES | C(CCOC(CCCCC(=O)OCCCCCCCC)=O)CCCCCCCCCCCCC |