SpectraBase Compound ID | 4PNsxLsxcEl |
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InChI | InChI=1S/C17H30O4/c1-14(2)12-20-16(18)10-6-7-11-17(19)21-13-15-8-4-3-5-9-15/h14-15H,3-13H2,1-2H3 |
InChIKey | CNBUCVZZCIEWDG-UHFFFAOYSA-N |
Mol Weight | 298.42 g/mol |
Molecular Formula | C17H30O4 |
Exact Mass | 298.214409 g/mol |
SpectraBase Spectrum ID | I51GXBqvOsA |
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Name | Adipic acid, cyclohexylmethyl isobutyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 298.214409442 u |
Formula | C17H30O4 |
InChI | InChI=1S/C17H30O4/c1-14(2)12-20-16(18)10-6-7-11-17(19)21-13-15-8-4-3-5-9-15/h14-15H,3-13H2,1-2H3 |
InChIKey | CNBUCVZZCIEWDG-UHFFFAOYSA-N |
SMILES | CC(C)COC(CCCCC(=O)OCC1CCCCC1)=O |