CID 11902903

L-alanyl-l-prolylglycine

Structural Information

Molecular Formula
C10H17N3O4
SMILES
C[C@@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)N
InChI
InChI=1S/C10H17N3O4/c1-6(11)10(17)13-4-2-3-7(13)9(16)12-5-8(14)15/h6-7H,2-5,11H2,1H3,(H,12,16)(H,14,15)/t6-,7-/m0/s1
InChIKey
UGTHTQWIQKEDEH-BQBZGAKWSA-N
Compound name
2-[[(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidine-2-carbonyl]amino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

30771
Patents

243.1219 Da
Monoisotopic Mass

-3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.12918 155.9
[M+Na]+ 266.11112 159.1
[M+NH4]+ 261.15572 159.3
[M+K]+ 282.08506 160.6
[M-H]- 242.11462 153.0
[M+Na-2H]- 264.09657 154.6
[M]+ 243.12135 154.5
[M]- 243.12245 154.5
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

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