SpectraBase Compound ID | ChvBRZ8Cexm |
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InChI | InChI=1S/C13H15F3O2/c1-8-5-6-9(12(2,3)4)10(7-8)18-11(17)13(14,15)16/h5-7H,1-4H3 |
InChIKey | SHCFEXJBCHSETN-UHFFFAOYSA-N |
Mol Weight | 260.26 g/mol |
Molecular Formula | C13H15F3O2 |
Exact Mass | 260.102414 g/mol |
SpectraBase Spectrum ID | 9gzKlvMvQ8p |
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Name | 2-Tert-butyl-5-methylphenol, trifluoroacetate |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 260.102414210 u |
Formula | C13H15F3O2 |
InChI | InChI=1S/C13H15F3O2/c1-8-5-6-9(12(2,3)4)10(7-8)18-11(17)13(14,15)16/h5-7H,1-4H3 |
InChIKey | SHCFEXJBCHSETN-UHFFFAOYSA-N |
Molecular Weight | 260.256 g/mol |
SMILES | C(C)(C)(C)C1=C(OC(C(F)(F)F)=O)C=C(C=C1)C |