CID 5962

L-lysine

Structural Information

Molecular Formula
C6H14N2O2
SMILES
C(CCN)C[C@@H](C(=O)O)N
InChI
InChI=1S/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1
InChIKey
KDXKERNSBIXSRK-YFKPBYRVSA-N
Compound name
(2S)-2,6-diaminohexanoic acid
Related CIDs

2D Structure

compound 2d structure
10
Annotation Hits

72083
References

207638
Patents

146.10553 Da
Monoisotopic Mass

-3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.11281 133.7
[M+Na]+ 169.09475 138.5
[M-H]- 145.09825 131.4
[M+NH4]+ 164.13935 153.0
[M+K]+ 185.06869 137.8
[M+H-H2O]+ 129.10279 128.2
[M+HCOO]- 191.10373 155.3
[M+CH3COO]- 205.11938 177.9
[M+Na-2H]- 167.08020 135.7
[M]+ 146.10498 130.1
[M]- 146.10608 130.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe