SpectraBase Compound ID | HjYq2ejphsG |
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InChI | InChI=1S/C17H32O4/c1-4-7-14-20-16(18)12-8-9-13-17(19)21-15(10-5-2)11-6-3/h15H,4-14H2,1-3H3 |
InChIKey | KHHODIAEIRZQGF-UHFFFAOYSA-N |
Mol Weight | 300.4 g/mol |
Molecular Formula | C17H32O4 |
Exact Mass | 300.23006 g/mol |
SpectraBase Spectrum ID | HS73if4Dyle |
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Name | Adipic acid, butyl 4-heptyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 300.230059506 u |
Formula | C17H32O4 |
InChI | InChI=1S/C17H32O4/c1-4-7-14-20-16(18)12-8-9-13-17(19)21-15(10-5-2)11-6-3/h15H,4-14H2,1-3H3 |
InChIKey | KHHODIAEIRZQGF-UHFFFAOYSA-N |
SMILES | C(CCC(OC(CCC)CCC)=O)CC(OCCCC)=O |