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6,10-Diaza-5-azoniaspiro[4.5]deca-2,6,8-triene, 2,3-dimethyl-7,8,9-tris[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-, hydroxide, inner salt

View entire compound with spectra: 1 MS (GC)

6,10-Diaza-5-azoniaspiro[4.5]deca-2,6,8-triene, 2,3-dimethyl-7,8,9-tris[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-, hydroxide, inner salt
SpectraBase Compound ID 1MJigxvnDNu
InChI InChI=1S/C18H10F21N3/c1-5-3-42(4-6(5)2)40-8(11(20,15(28,29)30)16(31,32)33)7(10(19,13(22,23)24)14(25,26)27)9(41-42)12(21,17(34,35)36)18(37,38)39/h3-4H2,1-2H3
InChIKey QCTIITSKBBQJBK-UHFFFAOYSA-N
Mol Weight 667.27 g/mol
Molecular Formula C18H10F21N3
Exact Mass 667.053939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3cWv65ir1nQ
Name 6,10-Diaza-5-azoniaspiro[4.5]deca-2,6,8-triene, 2,3-dimethyl-7,8,9-tris[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-, hydroxide, inner salt
CAS Registry Number 116417-22-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H10F21N3
InChI InChI=1S/C18H10F21N3/c1-5-3-42(4-6(5)2)40-8(11(20,15(28,29)30)16(31,32)33)7(10(19,13(22,23)24)14(25,26)27)9(41-42)12(21,17(34,35)36)18(37,38)39/h3-4H2,1-2H3
InChIKey QCTIITSKBBQJBK-UHFFFAOYSA-N
Molecular Weight 667.265 g/mol
SMILES C1(=C(C(C(F)(F)F)(C(F)(F)F)F)[N-][N+]2(N=C1C(C(F)(F)F)(C(F)(F)F)F)CC(C)=C(C2)C)C(C(F)(F)F)(C(F)(F)F)F
SPLASH splash10-001i-9000000000-9eeb809023176edcfd8b
Source of Spectrum KC-1990-2381-5
Synonyms 7,8,9-tris(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2,3-dimethyl-5,6,10-triazaspiro[4.5]deca-2,7,9-trien-5-ylium-6-ide Spiro[4,5,6-tri(heptafluoroisopropyl)-1,2,3-triazine,-2,1'-3,4-dimethyl-2',5'-dihydropyrrole]
Wiley ID 1413799