CID 155905987

7,8-difluoro-2,4-dimethylquinolin-3-amine

Structural Information

Molecular Formula
C11H10F2N2
SMILES
CC1=C2C=CC(=C(C2=NC(=C1N)C)F)F
InChI
InChI=1S/C11H10F2N2/c1-5-7-3-4-8(12)9(13)11(7)15-6(2)10(5)14/h3-4H,14H2,1-2H3
InChIKey
QFGPFNFBFAXOPN-UHFFFAOYSA-N
Compound name
7,8-difluoro-2,4-dimethylquinolin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.0812 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.08848 142.2
[M+Na]+ 231.07042 154.3
[M-H]- 207.07392 143.7
[M+NH4]+ 226.11502 161.6
[M+K]+ 247.04436 149.6
[M+H-H2O]+ 191.07846 134.2
[M+HCOO]- 253.07940 162.9
[M+CH3COO]- 267.09505 192.8
[M+Na-2H]- 229.05587 147.1
[M]+ 208.08065 140.2
[M]- 208.08175 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.