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(S,S)-N,N'-Bis(isoleucinyl)-1,3-diaminopropane
SpectraBase Compound ID IL9Tqub9567
InChI InChI=1S/C15H32N4O2/c1-5-10(3)12(16)14(20)18-8-7-9-19-15(21)13(17)11(4)6-2/h10-13H,5-9,16-17H2,1-4H3,(H,18,20)(H,19,21)/t10-,11-,12-,13-/m0/s1
InChIKey XDHHWJLZYPUPFI-CYDGBPFRSA-N
Mol Weight 300.4 g/mol
Molecular Formula C15H32N4O2
Exact Mass 300.252526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XhH9r0t7ui
Name (S,S)-N,N'-Bis(isoleucinyl)-1,3-diaminopropane
Alternate Name(s) (2S,3S)-2-amino-N-(3-{[(2S,3S)-2-amino-3-methylpentanoyl]amino}propyl)-3-methylpentanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H32N4O2
InChI InChI=1S/C15H32N4O2/c1-5-10(3)12(16)14(20)18-8-7-9-19-15(21)13(17)11(4)6-2/h10-13H,5-9,16-17H2,1-4H3,(H,18,20)(H,19,21)/t10-,11-,12-,13-/m0/s1
InChIKey XDHHWJLZYPUPFI-CYDGBPFRSA-N
Molecular Weight 300.447 g/mol
SMILES N[C@](C(=O)NCCCNC([C@@](N)([C@](CC)(C)[H])[H])=O)([C@](CC)(C)[H])[H]
SPLASH splash10-014r-8290000000-8492bb9119b82e300277
Source of Spectrum O-26-90-8
Wiley ID 1302673