CID 45791428

1-(1-methyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine dihydrochloride

Structural Information

Molecular Formula
C11H16N2
SMILES
CN1CCC(C2=CC=CC=C21)CN
InChI
InChI=1S/C11H16N2/c1-13-7-6-9(8-12)10-4-2-3-5-11(10)13/h2-5,9H,6-8,12H2,1H3
InChIKey
GXBXUDPXGOCGDI-UHFFFAOYSA-N
Compound name
(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

176.13135 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.138626 138.9
[M+Na]+ 199.120568 146.0
[M-H]- 175.124074 141.3
[M+NH4]+ 194.165173 158.6
[M+K]+ 215.094508 142.6
[M+H-H2O]+ 159.128610 132.1
[M+HCOO]- 221.129551 158.9
[M+CH3COO]- 235.145201 184.5
[M+Na-2H]- 197.106016 145.3
[M]+ 176.13080142 135.0
[M]- 176.13189858 135.0
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

patents stripe