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]+ 216.149516 147.7
[M+Na]+ 238.131458 155.5
[M-H]- 214.134964 152.4
[M+NH4]+ 233.176063 166.4
[M+K]+ 254.105398 152.3
[M+H-H2O]+ 198.139500 139.9
[M+HCOO]- 260.140441 172.3
[M+CH3COO]- 274.156091 198.1
[M+Na-2H]- 236.116906 155.7
[M]+ 215.14169142 148.2
[M]- 215.14278858 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.