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]+ 171.09168 141.4
[M+Na]+ 193.07362 152.3
[M-H]- 169.07712 146.9
[M+NH4]+ 188.11822 155.3
[M+K]+ 209.04756 147.8
[M+H-H2O]+ 153.08166 132.8
[M+HCOO]- 215.08260 163.1
[M+CH3COO]- 229.09825 154.2
[M+Na-2H]- 191.05907 150.6
[M]+ 170.08385 142.8
[M]- 170.08495 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.