CID 83826555

Sodium 2-[3-(dimethylamino)azetidin-1-yl]acetate

Structural Information

Molecular Formula
C7H14N2O2
SMILES
CN(C)C1CN(C1)CC(=O)O
InChI
InChI=1S/C7H14N2O2/c1-8(2)6-3-9(4-6)5-7(10)11/h6H,3-5H2,1-2H3,(H,10,11)
InChIKey
NSLQEHJMIVRIOS-UHFFFAOYSA-N
Compound name
2-[3-(dimethylamino)azetidin-1-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

158.10553 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.11281 136.5
[M+Na]+ 181.09475 140.9
[M-H]- 157.09825 138.5
[M+NH4]+ 176.13935 149.1
[M+K]+ 197.06869 144.7
[M+H-H2O]+ 141.10279 124.7
[M+HCOO]- 203.10373 156.4
[M+CH3COO]- 217.11938 184.9
[M+Na-2H]- 179.08020 139.4
[M]+ 158.10498 144.6
[M]- 158.10608 144.6
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

No patent data available for this compound.