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N(6)-(5-(1,2-Dithiolan-3-yl)valeryl)-L-lysine

View entire compound with spectra: 1 NMR

N(6)-(5-(1,2-Dithiolan-3-yl)valeryl)-L-lysine
SpectraBase Compound ID KuMj8mtLwzA
InChI InChI=1S/C14H26N2O3S2/c15-12(14(18)19)6-3-4-9-16-13(17)7-2-1-5-11-8-10-20-21-11/h11-12H,1-10,15H2,(H,16,17)(H,18,19)/t11?,12-/m0/s1
InChIKey COTIXRRJLCSLLS-KIYNQFGBSA-N
Mol Weight 334.49 g/mol
Molecular Formula C14H26N2O3S2
Exact Mass 334.138485 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LYK2FfP7VLa
Name N(6)-(5-(1,2-Dithiolan-3-yl)valeryl)-L-lysine
Comments Computed using HOSE algorithm
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Exact Mass 334.138485050 u
Formula C14H26N2O3S2
InChI InChI=1S/C14H26N2O3S2/c15-12(14(18)19)6-3-4-9-16-13(17)7-2-1-5-11-8-10-20-21-11/h11-12H,1-10,15H2,(H,16,17)(H,18,19)/t11?,12-/m0/s1
InChIKey COTIXRRJLCSLLS-KIYNQFGBSA-N
Molecular Weight 334.493 g/mol
SMILES [C@](CCCCNC(CCCCC1SSCC1)=O)(N)(C(O)=O)[H]