CID 227244

2,2-dimethylaziridine

Structural Information

Molecular Formula
C4H9N
SMILES
CC1(CN1)C
InChI
InChI=1S/C4H9N/c1-4(2)3-5-4/h5H,3H2,1-2H3
InChIKey
FGRJGEWVJCCOJJ-UHFFFAOYSA-N
Compound name
2,2-dimethylaziridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

820
Patents

71.0735 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 72.080776 115.8
[M+Na]+ 94.062718 126.1
[M-H]- 70.066224 118.4
[M+NH4]+ 89.107323 135.4
[M+K]+ 110.03666 125.1
[M+H-H2O]+ 54.070760 111.2
[M+HCOO]- 116.07170 137.6
[M+CH3COO]- 130.08735 163.4
[M+Na-2H]- 92.048166 124.8
[M]+ 71.072951 116.5
[M]- 71.074049 116.5
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