CID 212105

23918-75-4

Structural Information

Molecular Formula
C13H17N3
SMILES
CN(C)CCN1C=CC(=N)C2=CC=CC=C21
InChI
InChI=1S/C13H17N3/c1-15(2)9-10-16-8-7-12(14)11-5-3-4-6-13(11)16/h3-8,14H,9-10H2,1-2H3
InChIKey
JFEIRUWDZMSLRN-UHFFFAOYSA-N
Compound name
2-(4-iminoquinolin-1-yl)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.14224 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.14952 147.7
[M+Na]+ 238.13146 155.5
[M-H]- 214.13496 152.4
[M+NH4]+ 233.17606 166.4
[M+K]+ 254.10540 152.3
[M+H-H2O]+ 198.13950 139.9
[M+HCOO]- 260.14044 172.3
[M+CH3COO]- 274.15609 198.1
[M+Na-2H]- 236.11691 155.7
[M]+ 215.14169 148.2
[M]- 215.14279 148.2
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.