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2,2,2-trifluoro-N-[2,2,2-trideuterio-1-[(2,3,4,5,6-pentadeuteriophenyl)methyl]ethyl]acetamide
SpectraBase Compound ID J9MHiQN7XZ9
InChI InChI=1S/C11H12F3NO/c1-8(15-10(16)11(12,13)14)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,15,16)/i1D3,2D,3D,4D,5D,6D
InChIKey DMOCTORDHSLHLA-JGUCLWPXSA-N
Mol Weight 239.27 g/mol
Molecular Formula C11H4D8F3NO
Exact Mass 239.137312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBmE4GoEj3M
Name 2,2,2-trifluoro-N-[2,2,2-trideuterio-1-[(2,3,4,5,6-pentadeuteriophenyl)methyl]ethyl]acetamide
Alternate Name(s) 2,2,2-trifluoro-N-(1-(phenyl-d5)propan-2-yl-3,3,3-d3)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H4D8F3NO
InChI InChI=1S/C11H12F3NO/c1-8(15-10(16)11(12,13)14)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,15,16)/i1D3,2D,3D,4D,5D,6D
InChIKey DMOCTORDHSLHLA-JGUCLWPXSA-N
Literature Reference DOI 10.1002/rcm.3010
Molecular Weight 239.267 g/mol
SMILES N(C(Cc1c(c(c(c(c1[D])[D])[D])[D])[D])C([D])([D])[D])C(C(F)(F)F)=O
SPLASH splash10-004m-5900000000-1bb003fba322adf687b9
Source of Spectrum RCM-21-1709-AP_d8_TFA
Wiley ID 1814335