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1-(3-(Trifluoromethyl)phenyl)-2-tert-butylamino-propan-1-one TFA
SpectraBase Compound ID GNVQjxuW9dh
InChI InChI=1S/C16H17F6NO2/c1-9(23(14(2,3)4)13(25)16(20,21)22)12(24)10-6-5-7-11(8-10)15(17,18)19/h5-9H,1-4H3
InChIKey RIRBULPZXMDEAI-UHFFFAOYSA-N
Mol Weight 369.31 g/mol
Molecular Formula C16H17F6NO2
Exact Mass 369.116348 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FkjJ97tpM8
Name 1-(3-(Trifluoromethyl)phenyl)-2-tert-butylamino-propan-1-one TFA
Classification Designer drug precursor derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 369.116347767 u
Formula C16H17F6NO2
InChI InChI=1S/C16H17F6NO2/c1-9(23(14(2,3)4)13(25)16(20,21)22)12(24)10-6-5-7-11(8-10)15(17,18)19/h5-9H,1-4H3
InChIKey RIRBULPZXMDEAI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 369.307 g/mol
Nominal Mass 369 u
Quality 997
Retention Index 2657
SMILES C(N(C(C(C=1C=C(C(F)(F)F)C=CC1)=O)C)C(C)(C)C)(C(F)(F)F)=O
SPLASH splash10-0a4i-9300000000-f48f731a33d9041e4b69
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-tert-butyl(trifluoro)-N-(1-oxo-1-(3-(trifluoromethyl)phenyl)propan-2-yl)acetamide
Technique GC/MS
Wiley ID DD2024_004124