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6-Chloro-2-pentafluoroethyl-3-trifluoromethyl-9-oxa-1,4a-diazafluoren-4-one
SpectraBase Compound ID Ki7VGlnz0C0
InChI InChI=1S/C13H3ClF8N2O2/c14-4-1-2-6-5(3-4)24-9(25)7(12(17,18)19)8(23-10(24)26-6)11(15,16)13(20,21)22/h1-3H
InChIKey MRBXDXIFPKZIJI-UHFFFAOYSA-N
Mol Weight 406.62 g/mol
Molecular Formula C13H3ClF8N2O2
Exact Mass 405.97553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DsYIusNTX3K
Name 6-Chloro-2-pentafluoroethyl-3-trifluoromethyl-9-oxa-1,4a-diazafluoren-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H3ClF8N2O2
InChI InChI=1S/C13H3ClF8N2O2/c14-4-1-2-6-5(3-4)24-9(25)7(12(17,18)19)8(23-10(24)26-6)11(15,16)13(20,21)22/h1-3H
InChIKey MRBXDXIFPKZIJI-UHFFFAOYSA-N
Molecular Weight 406.619 g/mol
SMILES C1=2Oc3ccc(cc3N1C(C(=C(N2)C(C(F)(F)F)(F)F)C(F)(F)F)=O)Cl
SPLASH splash10-0a4i-0130900000-4436635e9931ccde308f
Source of Spectrum QC-23-1019-3
Synonyms 7-Chloro-2-(1,1,2,2,2-pentafluoroethyl)-3-(trifluoromethyl)-4H-pyrimido[2,1-b][1,3]benzoxazol-4-one
Wiley ID 1583934