5'-(DIMETHYLAMINO)-3',4'-DIHYDROXY-2'-OXOSPIRO-[CYCLOHEPTAN-1,4'-[2H]-IMIDAZOLINUM]-TRIFLUOROACETAMIDATE

SpectraBase Compound ID	EShzZnmGiJ3
InChI	InChI=1S/C13H19F3N4O2/c1-19(2)10-12(7-5-3-4-6-8-12)17-11(22)20(10)18-9(21)13(14,15)16/h3-8H2,1-2H3,(H-,17,18,21,22)
InChIKey	FRZCUNCAQLLFMF-UHFFFAOYSA-N Google Search
Mol Weight	320.32 g/mol
Molecular Formula	C13H19F3N4O2
Exact Mass	320.14601 g/mol

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SpectraBase Spectrum ID	jnqOhSuGDN
Name	1,3-Diazaspiro[4.6]undecane, 1-aza-3-azoniaspiro[4.6]undec-3-ene deriv.
Alternate Name(s)	1-Aza-3-azoniaspiro[4.6]undec-3-ene, 4-(dimethylamino)-2-oxo-3-[(trifluoroacetyl)amino]-, hydroxide, inner salt 4-(dimethylamino)-2-oxo-3-(2,2,2-trifluoroacetamido)-1,3-diazaspiro[4.6]undec-3-en-3-ium-1-ide 5'-(dimethylamino)-3',4'-dihydro-2'-pxpspiro[cycloheptane-1,4'-[2H]imidazolium]-trifluoroacetamidate
CAS Registry Number	128945-28-8
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H19F3N4O2
InChI	InChI=1S/C13H19F3N4O2/c1-19(2)10-12(7-5-3-4-6-8-12)17-11(22)20(10)18-9(21)13(14,15)16/h3-8H2,1-2H3,(H-,17,18,21,22)
InChIKey	FRZCUNCAQLLFMF-UHFFFAOYSA-N
Molecular Weight	320.316 g/mol
SMILES	N([N+]=1C([N-]C2(C1N(C)C)CCCCCC2)=O)C(C(F)(F)F)=O
SPLASH	splash10-00or-0890000000-ead76c1e1e73fe047e84
Source of Spectrum	H-73-502-3
Wiley ID	1319741