SpectraBase Compound ID | IXf2g0rdOjQ |
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InChI | InChI=1S/C18H34O4/c1-4-6-8-11-15-21-17(19)13-9-10-14-18(20)22-16(3)12-7-5-2/h16H,4-15H2,1-3H3 |
InChIKey | HNKYUTGAKSLQIS-UHFFFAOYSA-N |
Mol Weight | 314.5 g/mol |
Molecular Formula | C18H34O4 |
Exact Mass | 314.24571 g/mol |
SpectraBase Spectrum ID | 2csKwgP1Djp |
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Name | Adipic acid, hexyl 2-hexyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 314.245709571 u |
Formula | C18H34O4 |
InChI | InChI=1S/C18H34O4/c1-4-6-8-11-15-21-17(19)13-9-10-14-18(20)22-16(3)12-7-5-2/h16H,4-15H2,1-3H3 |
InChIKey | HNKYUTGAKSLQIS-UHFFFAOYSA-N |
SMILES | C(C(OC(C)CCCC)=O)CCCC(OCCCCCC)=O |