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4,4'-(tetramethylenedinitrilo)bis[1,1,1-trifluoro-2-pentanone]
SpectraBase Compound ID 6K8rNLDcOfQ
InChI InChI=1S/C14H18F6N2O2/c1-9(7-11(23)13(15,16)17)21-5-3-4-6-22-10(2)8-12(24)14(18,19)20/h3-8H2,1-2H3/b21-9+,22-10+
InChIKey VSOOQTUZRPBHIO-VGENTYGXSA-N
Mol Weight 360.3 g/mol
Molecular Formula C14H18F6N2O2
Exact Mass 360.127247 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B7RBlcPcF63
Name (4Z)-1,1,1-Trifluoro-4-[((Z)-4-([(Z)-4,4,4-trifluoro-1-methyl-3-oxobutylidene]amino)butyl)imino]-2-pentanone
Alternate Name(s) N,N'-Butylenebis(5,5,5-trifluoro-4-oxopentan-2-imine)
CAS Registry Number 87961-37-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18F6N2O2
InChI InChI=1S/C14H18F6N2O2/c1-9(7-11(23)13(15,16)17)21-5-3-4-6-22-10(2)8-12(24)14(18,19)20/h3-8H2,1-2H3/b21-9+,22-10+
InChIKey VSOOQTUZRPBHIO-VGENTYGXSA-N
Molecular Weight 360.300 g/mol
SMILES C\C(CC(=O)C(F)(F)F)=N/CCCC\N=C/(C)CC(=O)C(F)(F)F
SPLASH splash10-0bti-6930000000-fed05b4123c9c359bb17
Source of Spectrum W5-1989-35486-30050
Wiley ID 1348018