CID 459656

2-(aziridin-1-yl)quinoline

Structural Information

Molecular Formula
C11H10N2
SMILES
C1CN1C2=NC3=CC=CC=C3C=C2
InChI
InChI=1S/C11H10N2/c1-2-4-10-9(3-1)5-6-11(12-10)13-7-8-13/h1-6H,7-8H2
InChIKey
VSODRMPDFKMECP-UHFFFAOYSA-N
Compound name
2-(aziridin-1-yl)quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.0844 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.091676 141.4
[M+Na]+ 193.073618 152.3
[M-H]- 169.077124 146.9
[M+NH4]+ 188.118223 155.3
[M+K]+ 209.047558 147.8
[M+H-H2O]+ 153.081660 132.8
[M+HCOO]- 215.082601 163.1
[M+CH3COO]- 229.098251 154.2
[M+Na-2H]- 191.059066 150.6
[M]+ 170.08385142 142.8
[M]- 170.08494858 142.8
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

No patent data available for this compound.