SpectraBase Compound ID | EDwW9KFEAF9 |
---|---|
InChI | InChI=1S/C11H11F3N4O/c12-11(13,14)9-8-10(16-5-15-9)18(6-17-8)7-3-1-2-4-19-7/h5-7H,1-4H2 |
InChIKey | ZCWPPKMPYUKDLG-UHFFFAOYSA-N |
Mol Weight | 272.23 g/mol |
Molecular Formula | C11H11F3N4O |
Exact Mass | 272.088495 g/mol |
SpectraBase Spectrum ID | J0f3R9DgVxK |
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Name | 9-(Teytrahydropyran-2'-yl)-6-(trifluoromethyl)purine |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 272.088495478 u |
Formula | C11H11F3N4O |
InChI | InChI=1S/C11H11F3N4O/c12-11(13,14)9-8-10(16-5-15-9)18(6-17-8)7-3-1-2-4-19-7/h5-7H,1-4H2 |
InChIKey | ZCWPPKMPYUKDLG-UHFFFAOYSA-N |
Molecular Weight | 272.231 g/mol |
SMILES | C=12N(C=NC2=C(C(F)(F)F)N=CN1)C1OCCCC1 |