CID 339548

2,7-quinolinediamine, n2,n7,n7-trimethyl-

Structural Information

Molecular Formula
C12H15N3
SMILES
CNC1=NC2=C(C=CC(=C2)N(C)C)C=C1
InChI
InChI=1S/C12H15N3/c1-13-12-7-5-9-4-6-10(15(2)3)8-11(9)14-12/h4-8H,1-3H3,(H,13,14)
InChIKey
UVOZNPAUGBFZSH-UHFFFAOYSA-N
Compound name
2-N,7-N,7-N-trimethylquinoline-2,7-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

201.1266 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.13388 143.8
[M+Na]+ 224.11582 151.8
[M-H]- 200.11932 148.7
[M+NH4]+ 219.16042 163.2
[M+K]+ 240.08976 149.4
[M+H-H2O]+ 184.12386 136.2
[M+HCOO]- 246.12480 168.6
[M+CH3COO]- 260.14045 195.9
[M+Na-2H]- 222.10127 152.4
[M]+ 201.12605 144.7
[M]- 201.12715 144.7
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.