CID 549381

Methyl (2r,4r)-4-hydroxypyrrolidine-2-carboxylate hydrochloride

Structural Information

Molecular Formula
C6H11NO3
SMILES
COC(=O)C1CC(CN1)O
InChI
InChI=1S/C6H11NO3/c1-10-6(9)5-2-4(8)3-7-5/h4-5,7-8H,2-3H2,1H3
InChIKey
ZORHSASAYVIBLY-UHFFFAOYSA-N
Compound name
methyl 4-hydroxypyrrolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1299
Patents

145.0739 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.08118 130.3
[M+Na]+ 168.06312 136.8
[M-H]- 144.06662 129.7
[M+NH4]+ 163.10772 150.7
[M+K]+ 184.03706 135.9
[M+H-H2O]+ 128.07116 125.0
[M+HCOO]- 190.07210 149.2
[M+CH3COO]- 204.08775 167.0
[M+Na-2H]- 166.04857 132.8
[M]+ 145.07335 126.9
[M]- 145.07445 126.9
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