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1-[2-(p-Tolyloxy)ethyl]-5-(trifluoromethoxy)indoline-2,3-dione
SpectraBase Compound ID 1jfqCK4raXt
InChI InChI=1S/C18H14F3NO4/c1-11-2-4-12(5-3-11)25-9-8-22-15-7-6-13(26-18(19,20)21)10-14(15)16(23)17(22)24/h2-7,10H,8-9H2,1H3
InChIKey LECKTLMECIFBIX-UHFFFAOYSA-N
Mol Weight 365.31 g/mol
Molecular Formula C18H14F3NO4
Exact Mass 365.087492 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4gVJhuBM3fO
Name 1-[2-(p-Tolyloxy)ethyl]-5-(trifluoromethoxy)indoline-2,3-dione
Comments Computed using HOSE algorithm
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Exact Mass 365.087492420 u
Formula C18H14F3NO4
InChI InChI=1S/C18H14F3NO4/c1-11-2-4-12(5-3-11)25-9-8-22-15-7-6-13(26-18(19,20)21)10-14(15)16(23)17(22)24/h2-7,10H,8-9H2,1H3
InChIKey LECKTLMECIFBIX-UHFFFAOYSA-N
Molecular Weight 365.308 g/mol
SMILES C1(N(C2=C(C1=O)C=C(C=C2)OC(F)(F)F)CCOC1=CC=C(C=C1)C)=O