CID 12953690

2-methylcyclopropan-1-amine

Structural Information

Molecular Formula
C4H9N
SMILES
CC1CC1N
InChI
InChI=1S/C4H9N/c1-3-2-4(3)5/h3-4H,2,5H2,1H3
InChIKey
PYTANBUURZFYHD-UHFFFAOYSA-N
Compound name
2-methylcyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

524
Patents

71.0735 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 72.080776 110.5
[M+Na]+ 94.062718 120.7
[M-H]- 70.066224 115.5
[M+NH4]+ 89.107323 130.0
[M+K]+ 110.036658 119.2
[M+H-H2O]+ 54.070760 105.5
[M+HCOO]- 116.071701 135.8
[M+CH3COO]- 130.087351 168.7
[M+Na-2H]- 92.048166 118.0
[M]+ 71.07295142 111.0
[M]- 71.07404858 111.0
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