SpectraBase Compound ID | 2PoUwPv0Szh |
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InChI | InChI=1S/C15H30O2/c1-11(2)8-13(4)17-14(16)9-12(3)10-15(5,6)7/h11-13H,8-10H2,1-7H3 |
InChIKey | LLGLURCCPYKGIJ-UHFFFAOYSA-N |
Mol Weight | 242.4 g/mol |
Molecular Formula | C15H30O2 |
Exact Mass | 242.22458 g/mol |
SpectraBase Spectrum ID | tfgPJi9mfs |
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Name | Hexanoic acid, 3,5,5-trimethyl-, 4-methyl-2-pentyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 242.224580204 u |
Formula | C15H30O2 |
InChI | InChI=1S/C15H30O2/c1-11(2)8-13(4)17-14(16)9-12(3)10-15(5,6)7/h11-13H,8-10H2,1-7H3 |
InChIKey | LLGLURCCPYKGIJ-UHFFFAOYSA-N |
Molecular Weight | 242.403 g/mol |
SMILES | C(CC(OC(CC(C)C)C)=O)(CC(C)(C)C)C |