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2,6-Diaminoheptanedioic acid
SpectraBase Compound ID AV9Kv51gVtn
InChI InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)
InChIKey GMKMEZVLHJARHF-UHFFFAOYSA-N
Mol Weight 190.2 g/mol
Molecular Formula C7H14N2O4
Exact Mass 190.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8YBQeoP1X8T
Name 2,6-Diaminopimelic acid, 4TMS
Comments Non-derivatized structure shown; Derivatization type: 4 TMS (mass: 478.253); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000162; Note: The molecular formula of the structure shown is C7H14N2O4 - which differs from the formula reported for the mass spectrum (C19H46N2O4Si4)
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Formula C19H46N2O4Si4
InChI InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)
InChIKey GMKMEZVLHJARHF-UHFFFAOYSA-N
Molecular Weight 190.199 g/mol
SMILES OC(C(CCCC(C(=O)O)N)N)=O
SPLASH splash10-0ufr-0950000000-27a42ff153a9f8d6268f
Source of Spectrum FM-2019-162-0
Synonyms ll-diaminopimelate, 4TMS meso-A2pm, 4TMS meso-diaminopimelate, 4TMS D,L-diaminopimelate, 4TMS L,L-diaminopimelate, 4TMS 2,6-Diaminopimelic acid, 4TMS 2,6-Diaminoheptanedioic acid, 4TMS 2,6-Diaminoheptanedioic acid
Wiley ID 1817855