SpectraBase Compound ID | F2TWckLSbtz |
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InChI | InChI=1S/C15H18F3NO3/c1-3-4-9-22-13(20)10-19(2)14(21)11-5-7-12(8-6-11)15(16,17)18/h5-8H,3-4,9-10H2,1-2H3 |
InChIKey | CDDHFWRUHGHOSZ-UHFFFAOYSA-N |
Mol Weight | 317.31 g/mol |
Molecular Formula | C15H18F3NO3 |
Exact Mass | 317.123878 g/mol |
SpectraBase Spectrum ID | 1rBnzNSwcQN |
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Name | Sarcosine, N-(4-trifluoromethylbenzoyl)-, butyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 317.123877930 u |
Formula | C15H18F3NO3 |
InChI | InChI=1S/C15H18F3NO3/c1-3-4-9-22-13(20)10-19(2)14(21)11-5-7-12(8-6-11)15(16,17)18/h5-8H,3-4,9-10H2,1-2H3 |
InChIKey | CDDHFWRUHGHOSZ-UHFFFAOYSA-N |
Molecular Weight | 317.308 g/mol |
SMILES | C(CN(C(=O)C=1C=CC(C(F)(F)F)=CC1)C)(OCCCC)=O |