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7,9-Bis(trifluoroacetoxy)-5,6,7,8-tetrahydro-5,8-methanophthalzine 3-oxide
SpectraBase Compound ID 5YmnwB3Dm9f
InChI InChI=1S/C13H8F6N2O5/c14-12(15,16)10(22)25-7-1-4-6-3-21(24)20-2-5(6)8(7)9(4)26-11(23)13(17,18)19/h2-4,7-9H,1H2/t4-,7+,8-,9?/m0/s1
InChIKey LRKWCQGIDDLPCR-YOAOINENSA-N
Mol Weight 386.21 g/mol
Molecular Formula C13H8F6N2O5
Exact Mass 386.03374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GudfNSMopHS
Name 7,9-Bis(trifluoroacetoxy)-5,6,7,8-tetrahydro-5,8-methanophthalzine 3-oxide
Alternate Name(s) 4-Oxido-11-[(trifluoroacetyl)oxy]-4,5-diazatricyclo[6.2.1.0(2,7)]undeca-2,4,6-trien-9-yl trifluoroacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8F6N2O5
InChI InChI=1S/C13H8F6N2O5/c14-12(15,16)10(22)25-7-1-4-6-3-21(24)20-2-5(6)8(7)9(4)26-11(23)13(17,18)19/h2-4,7-9H,1H2/t4-,7+,8-,9?/m0/s1
InChIKey LRKWCQGIDDLPCR-YOAOINENSA-N
Molecular Weight 386.206 g/mol
SMILES C1([C@]2(c3cn[n+](cc3[C@@]1(C[C@]2(OC(C(F)(F)F)=O)[H])[H])[O-])[H])OC(C(F)(F)F)=O
SPLASH splash10-06g1-4932000000-4233230a79e11f9ad53c
Source of Spectrum AJ-71-500-11
Wiley ID 774310