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(S,S)-N,N'-Bis(isoleucinyl)-1,2-diaminoethane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(S,S)-N,N'-Bis(isoleucinyl)-1,2-diaminoethane
SpectraBase Compound ID jYdEcElXuJ
InChI InChI=1S/C14H30N4O2/c1-5-9(3)11(15)13(19)17-7-8-18-14(20)12(16)10(4)6-2/h9-12H,5-8,15-16H2,1-4H3,(H,17,19)(H,18,20)/t9-,10-,11-,12-/m0/s1
InChIKey KXENLEPGMAIQJC-BJDJZHNGSA-N
Mol Weight 286.42 g/mol
Molecular Formula C14H30N4O2
Exact Mass 286.236876 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2xmeFID6jVa
Name (S,S)-N,N'-bis(Isoleucinyl)-1,2-diaminoethane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.236876220 u
Formula C14H30N4O2
InChI InChI=1S/C14H30N4O2/c1-5-9(3)11(15)13(19)17-7-8-18-14(20)12(16)10(4)6-2/h9-12H,5-8,15-16H2,1-4H3,(H,17,19)(H,18,20)/t9-,10-,11-,12-/m0/s1
InChIKey KXENLEPGMAIQJC-BJDJZHNGSA-N
SMILES C([C@@](N)([C@](CC)(C)[H])[H])(=O)NCCNC([C@@](N)([C@](CC)(C)[H])[H])=O