CID 61156945

Hydroxyprolyl-proline

Structural Information

Molecular Formula
C10H16N2O4
SMILES
C1CC(N(C1)C(=O)C2CC(CN2)O)C(=O)O
InChI
InChI=1S/C10H16N2O4/c13-6-4-7(11-5-6)9(14)12-3-1-2-8(12)10(15)16/h6-8,11,13H,1-5H2,(H,15,16)
InChIKey
GIOMWAZJQDYWEU-UHFFFAOYSA-N
Compound name
1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

228.11101 Da
Monoisotopic Mass

-3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.11829 153.0
[M+Na]+ 251.10023 157.1
[M-H]- 227.10373 152.7
[M+NH4]+ 246.14483 169.2
[M+K]+ 267.07417 155.0
[M+H-H2O]+ 211.10827 146.4
[M+HCOO]- 273.10921 166.4
[M+CH3COO]- 287.12486 179.9
[M+Na-2H]- 249.08568 149.2
[M]+ 228.11046 145.7
[M]- 228.11156 145.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe