CID 151428

Lysyl-serine

Structural Information

Molecular Formula
C9H19N3O4
SMILES
C(CCN)C[C@@H](C(=O)N[C@@H](CO)C(=O)O)N
InChI
InChI=1S/C9H19N3O4/c10-4-2-1-3-6(11)8(14)12-7(5-13)9(15)16/h6-7,13H,1-5,10-11H2,(H,12,14)(H,15,16)/t6-,7-/m0/s1
InChIKey
YSZNURNVYFUEHC-BQBZGAKWSA-N
Compound name
(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-hydroxypropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4948
Patents

233.13756 Da
Monoisotopic Mass

-4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.14484 154.8
[M+Na]+ 256.12678 156.8
[M+NH4]+ 251.17138 157.5
[M+K]+ 272.10072 156.8
[M-H]- 232.13028 150.9
[M+Na-2H]- 254.11223 152.3
[M]+ 233.13701 152.8
[M]- 233.13811 152.8
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