CID 2041326

3-(pyrrolidin-1-yl)quinoxalin-2-amine

Structural Information

Molecular Formula
C12H14N4
SMILES
C1CCN(C1)C2=NC3=CC=CC=C3N=C2N
InChI
InChI=1S/C12H14N4/c13-11-12(16-7-3-4-8-16)15-10-6-2-1-5-9(10)14-11/h1-2,5-6H,3-4,7-8H2,(H2,13,14)
InChIKey
LWWDIFFPFOZSSB-UHFFFAOYSA-N
Compound name
3-pyrrolidin-1-ylquinoxalin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

214.12184 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.12912 147.3
[M+Na]+ 237.11106 155.2
[M-H]- 213.11456 150.3
[M+NH4]+ 232.15566 164.0
[M+K]+ 253.08500 150.6
[M+H-H2O]+ 197.11910 137.9
[M+HCOO]- 259.12004 166.6
[M+CH3COO]- 273.13569 158.9
[M+Na-2H]- 235.09651 152.8
[M]+ 214.12129 143.1
[M]- 214.12239 143.1
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

No patent data available for this compound.