CID 46941551

3-methoxypyrrolidin-1-amine

Structural Information

Molecular Formula
C5H12N2O
SMILES
COC1CCN(C1)N
InChI
InChI=1S/C5H12N2O/c1-8-5-2-3-7(6)4-5/h5H,2-4,6H2,1H3
InChIKey
LEGLCGJGHWSXDJ-UHFFFAOYSA-N
Compound name
3-methoxypyrrolidin-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

116.09496 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.102236 123.1
[M+Na]+ 139.084178 130.0
[M-H]- 115.087684 124.7
[M+NH4]+ 134.128783 145.6
[M+K]+ 155.058118 129.8
[M+H-H2O]+ 99.092220 117.0
[M+HCOO]- 161.093161 146.0
[M+CH3COO]- 175.108811 169.9
[M+Na-2H]- 137.069626 127.6
[M]+ 116.09441142 119.8
[M]- 116.09550858 119.8
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