CID 11651149

1-methylcyclopropanamine

Structural Information

Molecular Formula
C4H9N
SMILES
CC1(CC1)N
InChI
InChI=1S/C4H9N/c1-4(5)2-3-4/h2-3,5H2,1H3
InChIKey
VSRXAWSAKJABKW-UHFFFAOYSA-N
Compound name
1-methylcyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2722
Patents

71.0735 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 72.080776 111.5
[M+Na]+ 94.062718 121.4
[M-H]- 70.066224 116.5
[M+NH4]+ 89.107323 132.5
[M+K]+ 110.03666 121.0
[M+H-H2O]+ 54.070760 107.5
[M+HCOO]- 116.07170 136.4
[M+CH3COO]- 130.08735 167.2
[M+Na-2H]- 92.048166 120.7
[M]+ 71.072951 112.0
[M]- 71.074049 112.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe