CID 59857770

1-methoxypyrrolidin-3-amine

Structural Information

Molecular Formula
C5H12N2O
SMILES
CON1CCC(C1)N
InChI
InChI=1S/C5H12N2O/c1-8-7-3-2-5(6)4-7/h5H,2-4,6H2,1H3
InChIKey
YGWSRJOLMOGEJU-UHFFFAOYSA-N
Compound name
1-methoxypyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

116.09496 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.10224 123.1
[M+Na]+ 139.08418 130.0
[M-H]- 115.08768 124.7
[M+NH4]+ 134.12878 145.6
[M+K]+ 155.05812 129.8
[M+H-H2O]+ 99.092220 117.0
[M+HCOO]- 161.09316 146.0
[M+CH3COO]- 175.10881 169.9
[M+Na-2H]- 137.06963 127.6
[M]+ 116.09441 119.8
[M]- 116.09551 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