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[bis(trifluoromethyl)methyl] (15)N(1),(15)N(2)-bis[(pentafluoroethylcarbonyl]-2,6-diaminohexanoate
SpectraBase Compound ID G7D7XKPQFQG
InChI InChI=1S/C15H12F16N2O4/c16-10(17,14(26,27)28)8(35)32-4-2-1-3-5(33-9(36)11(18,19)15(29,30)31)6(34)37-7(12(20,21)22)13(23,24)25/h5,7H,1-4H2,(H,32,35)(H,33,36)/i32+1,33+1
InChIKey SOELTZIDDGNUQW-JQSCYZIESA-N
Mol Weight 590.23 g/mol
Molecular Formula C15H12F1615N2O4
Exact Mass 590.048227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fRmiCF057C
Name [bis(trifluoromethyl)methyl] (15)N(1),(15)N(2)-bis[(pentafluoroethylcarbonyl]-2,6-diaminohexanoate
Comments Original formula: C15H12F16[15N]2O4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12F16N2O4
InChI InChI=1S/C15H12F16N2O4/c16-10(17,14(26,27)28)8(35)32-4-2-1-3-5(33-9(36)11(18,19)15(29,30)31)6(34)37-7(12(20,21)22)13(23,24)25/h5,7H,1-4H2,(H,32,35)(H,33,36)/i32+1,33+1
InChIKey SOELTZIDDGNUQW-JQSCYZIESA-N
Molecular Weight 590.232 g/mol
SMILES [15NH](C(C(C(F)(F)F)(F)F)=O)C(CCCC[15NH]C(C(C(F)(F)F)(F)F)=O)C(OC(C(F)(F)F)C(F)(F)F)=O
SPLASH splash10-003r-0690000000-e51d734ab6e8d2fb7e4c
Source of Spectrum JC-425-250-0
Wiley ID 1409135