CID 56773872

6-chloro-2-(methylamino)-1,8-naphthyridine-3-carbonitrile

Structural Information

Molecular Formula
C10H7ClN4
SMILES
CNC1=NC2=NC=C(C=C2C=C1C#N)Cl
InChI
InChI=1S/C10H7ClN4/c1-13-9-7(4-12)2-6-3-8(11)5-14-10(6)15-9/h2-3,5H,1H3,(H,13,14,15)
InChIKey
AZMZNNLTDUUOIQ-UHFFFAOYSA-N
Compound name
6-chloro-2-(methylamino)-1,8-naphthyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

218.03592 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.04320 147.3
[M+Na]+ 241.02514 161.9
[M+NH4]+ 236.06974 152.7
[M+K]+ 256.99908 151.0
[M-H]- 217.02864 142.8
[M+Na-2H]- 239.01059 152.2
[M]+ 218.03537 147.6
[M]- 218.03647 147.6
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.