CID 12448966

1-methylpyrrolidin-2-imine hydrochloride

Structural Information

Molecular Formula
C5H10N2
SMILES
CN1CCCC1=N
InChI
InChI=1S/C5H10N2/c1-7-4-2-3-5(7)6/h6H,2-4H2,1H3
InChIKey
KGVDKNYFTLFECV-UHFFFAOYSA-N
Compound name
1-methylpyrrolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

98.0844 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 99.091676 118.7
[M+Na]+ 121.07362 125.9
[M-H]- 97.077124 120.9
[M+NH4]+ 116.11822 142.2
[M+K]+ 137.04756 125.1
[M+H-H2O]+ 81.081660 112.9
[M+HCOO]- 143.08260 142.2
[M+CH3COO]- 157.09825 167.7
[M+Na-2H]- 119.05907 124.3
[M]+ 98.083851 114.3
[M]- 98.084949 114.3
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