CID 25227054

Serinyl-hydroxyproline

Structural Information

Molecular Formula
C8H14N2O5
SMILES
C1[C@H](CN([C@@H]1C(=O)O)C(=O)[C@H](CO)N)O
InChI
InChI=1S/C8H14N2O5/c9-5(3-11)7(13)10-2-4(12)1-6(10)8(14)15/h4-6,11-12H,1-3,9H2,(H,14,15)/t4-,5+,6+/m1/s1
InChIKey
IISAHBYOIFITKV-SRQIZXRXSA-N
Compound name
(2S,4R)-1-[(2S)-2-amino-3-hydroxypropanoyl]-4-hydroxypyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.09027 Da
Monoisotopic Mass

-5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.09755 147.3
[M+Na]+ 241.07949 151.9
[M-H]- 217.08299 144.9
[M+NH4]+ 236.12409 163.1
[M+K]+ 257.05343 150.9
[M+H-H2O]+ 201.08753 141.5
[M+HCOO]- 263.08847 162.9
[M+CH3COO]- 277.10412 182.3
[M+Na-2H]- 239.06494 144.8
[M]+ 218.08972 142.2
[M]- 218.09082 142.2
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

No patent data available for this compound.