CID 12765505

N-methylquinolin-6-amine

Structural Information

Molecular Formula
C10H10N2
SMILES
CNC1=CC2=C(C=C1)N=CC=C2
InChI
InChI=1S/C10H10N2/c1-11-9-4-5-10-8(7-9)3-2-6-12-10/h2-7,11H,1H3
InChIKey
XXTCHBBZIBFUCN-UHFFFAOYSA-N
Compound name
N-methylquinolin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

128
Patents

158.0844 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.09168 130.2
[M+Na]+ 181.07362 138.9
[M-H]- 157.07712 133.7
[M+NH4]+ 176.11822 150.8
[M+K]+ 197.04756 135.7
[M+H-H2O]+ 141.08166 123.5
[M+HCOO]- 203.08260 154.2
[M+CH3COO]- 217.09825 144.2
[M+Na-2H]- 179.05907 141.1
[M]+ 158.08385 129.5
[M]- 158.08495 129.5
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

patents stripe