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(S)-2,2,2-trifluoro-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SpectraBase Compound ID 4eqs8EcCXLc
InChI InChI=1S/C12H12F3NO/c13-12(14,15)11(17)16-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2,(H,16,17)/t10-/m0/s1
InChIKey WJPPUIAEPKFCCJ-JTQLQIEISA-N
Mol Weight 243.23 g/mol
Molecular Formula C12H12F3NO
Exact Mass 243.087098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6mWLgCFGfYq
Name (S)-2,2,2-Trifluoro-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 243.087098498 u
Formula C12H12F3NO
InChI InChI=1S/C12H12F3NO/c13-12(14,15)11(17)16-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2,(H,16,17)/t10-/m0/s1
InChIKey WJPPUIAEPKFCCJ-JTQLQIEISA-N
Molecular Weight 243.229 g/mol
SMILES [C@@]1(C=2C=CC=CC2CCC1)(NC(=O)C(F)(F)F)[H]