CID 14073

1-methylaziridine

Structural Information

Molecular Formula
C3H7N
SMILES
CN1CC1
InChI
InChI=1S/C3H7N/c1-4-2-3-4/h2-3H2,1H3
InChIKey
XLJQPXVBQNJNLW-UHFFFAOYSA-N
Compound name
1-methylaziridine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

17
References

2763
Patents

57.05785 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 58.065126 111.7
[M+Na]+ 80.047068 122.2
[M-H]- 56.050574 115.5
[M+NH4]+ 75.091673 130.6
[M+K]+ 96.021008 121.5
[M+H-H2O]+ 40.055110 105.8
[M+HCOO]- 102.05605 135.6
[M+CH3COO]- 116.07170 163.6
[M+Na-2H]- 78.032516 120.7
[M]+ 57.057301 113.4
[M]- 57.058399 113.4
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