CID 374034

Nsc651213

Structural Information

Molecular Formula
C11H8N4
SMILES
C1=CC=C2C(=C1)C(=C3C(=N2)N=CC=N3)N
InChI
InChI=1S/C11H8N4/c12-9-7-3-1-2-4-8(7)15-11-10(9)13-5-6-14-11/h1-6H,(H2,12,14,15)
InChIKey
VUYGZHXOMBSURO-UHFFFAOYSA-N
Compound name
pyrazino[2,3-b]quinolin-10-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.07489 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.08217 139.9
[M+Na]+ 219.06411 151.6
[M-H]- 195.06761 141.7
[M+NH4]+ 214.10871 157.1
[M+K]+ 235.03805 146.1
[M+H-H2O]+ 179.07215 131.2
[M+HCOO]- 241.07309 161.3
[M+CH3COO]- 255.08874 153.0
[M+Na-2H]- 217.04956 152.7
[M]+ 196.07434 140.2
[M]- 196.07544 140.2
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.