CID 43450835

2-n-methylquinoline-2,6-diamine

Structural Information

Molecular Formula
C10H11N3
SMILES
CNC1=NC2=C(C=C1)C=C(C=C2)N
InChI
InChI=1S/C10H11N3/c1-12-10-5-2-7-6-8(11)3-4-9(7)13-10/h2-6H,11H2,1H3,(H,12,13)
InChIKey
BEMQTCZGJYRYHA-UHFFFAOYSA-N
Compound name
2-N-methylquinoline-2,6-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

173.09529 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.10257 134.6
[M+Na]+ 196.08451 143.4
[M-H]- 172.08801 137.8
[M+NH4]+ 191.12911 154.2
[M+K]+ 212.05845 139.7
[M+H-H2O]+ 156.09255 127.7
[M+HCOO]- 218.09349 159.0
[M+CH3COO]- 232.10914 148.0
[M+Na-2H]- 194.06996 144.1
[M]+ 173.09474 132.6
[M]- 173.09584 132.6
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

patents stripe