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(4s,5s)-2-amino-2-(2'-aminoethyl)-3-hydroxybutyric acid-methylester-dihydrochloride
SpectraBase Compound ID Ep4s6NytssC
InChI InChI=1S/C7H16N2O3.2Cl/c1-5(10)7(9,3-4-8)6(11)12-2;;/h5,10H,3-4,8-9H2,1-2H3;;
InChIKey LGROUSZCVSDIBZ-UHFFFAOYSA-N
Mol Weight 247.12 g/mol
Molecular Formula C7H16Cl2N2O3
Exact Mass 246.053798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4TQmADiqmkX
Name (4s,5s)-2-amino-2-(2'-aminoethyl)-3-hydroxybutyric acid-methylester-dihydrochloride
Alternate Name(s) 1,3-Diamino-1,2,3,5-tetradeoxy-3-(methoxycarbonyl)pentitol dihydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H18Cl2N2O3
InChI InChI=1S/C7H16N2O3.2Cl/c1-5(10)7(9,3-4-8)6(11)12-2;;/h5,10H,3-4,8-9H2,1-2H3;;
InChIKey LGROUSZCVSDIBZ-UHFFFAOYSA-N
Molecular Weight 249.138 g/mol
SMILES Cl.OC(C(CCN)(C(=O)OC)N)C.Cl
SPLASH splash10-0f80-9400000000-51b4b44bbfd31e9cc550
Source of Spectrum H-68-1602-30
Wiley ID 1250385