CID 10679144

2-ethylquinoline-4,6-diamine

Structural Information

Molecular Formula
C11H13N3
SMILES
CCC1=CC(=C2C=C(C=CC2=N1)N)N
InChI
InChI=1S/C11H13N3/c1-2-8-6-10(13)9-5-7(12)3-4-11(9)14-8/h3-6H,2,12H2,1H3,(H2,13,14)
InChIKey
AISUEAAFEZCUCS-UHFFFAOYSA-N
Compound name
2-ethylquinoline-4,6-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.11095 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.11823 140.4
[M+Na]+ 210.10017 149.7
[M-H]- 186.10367 143.3
[M+NH4]+ 205.14477 159.5
[M+K]+ 226.07411 145.5
[M+H-H2O]+ 170.10821 133.6
[M+HCOO]- 232.10915 163.7
[M+CH3COO]- 246.12480 189.4
[M+Na-2H]- 208.08562 147.4
[M]+ 187.11040 138.1
[M]- 187.11150 138.1
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.