CID 3071282

Brn 5951548

Structural Information

Molecular Formula
C17H22N2
SMILES
CC1CCCCN1C2=CC(=NC3=C(C=CC=C23)C)C
InChI
InChI=1S/C17H22N2/c1-12-7-6-9-15-16(11-13(2)18-17(12)15)19-10-5-4-8-14(19)3/h6-7,9,11,14H,4-5,8,10H2,1-3H3
InChIKey
PFTJCWBXHOCDHM-UHFFFAOYSA-N
Compound name
2,8-dimethyl-4-(2-methylpiperidin-1-yl)quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.1783 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.18558 162.7
[M+Na]+ 277.16752 170.1
[M-H]- 253.17102 167.0
[M+NH4]+ 272.21212 178.3
[M+K]+ 293.14146 164.8
[M+H-H2O]+ 237.17556 153.3
[M+HCOO]- 299.17650 178.7
[M+CH3COO]- 313.19215 173.4
[M+Na-2H]- 275.15297 166.2
[M]+ 254.17775 159.6
[M]- 254.17885 159.6
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

No patent data available for this compound.