CID 103975925

3-(methoxymethyl)pyrrolidine-3-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C7H13NO3
SMILES
COCC1(CCNC1)C(=O)O
InChI
InChI=1S/C7H13NO3/c1-11-5-7(6(9)10)2-3-8-4-7/h8H,2-5H2,1H3,(H,9,10)
InChIKey
UUNNQLNQGNNXKE-UHFFFAOYSA-N
Compound name
3-(methoxymethyl)pyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

159.08954 Da
Monoisotopic Mass

-3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.09682 134.5
[M+Na]+ 182.07876 140.5
[M-H]- 158.08226 133.7
[M+NH4]+ 177.12336 156.0
[M+K]+ 198.05270 139.5
[M+H-H2O]+ 142.08680 129.7
[M+HCOO]- 204.08774 153.1
[M+CH3COO]- 218.10339 169.1
[M+Na-2H]- 180.06421 138.5
[M]+ 159.08899 131.5
[M]- 159.09009 131.5
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