CID 58292

4-(dimethylamino)methyleneaminoquinaldine

Structural Information

Molecular Formula
C13H15N3
SMILES
CC1=NC2=CC=CC=C2C(=C1)N=CN(C)C
InChI
InChI=1S/C13H15N3/c1-10-8-13(14-9-16(2)3)11-6-4-5-7-12(11)15-10/h4-9H,1-3H3
InChIKey
JSSMTNFNQJIGJE-UHFFFAOYSA-N
Compound name
N,N-dimethyl-N'-(2-methylquinolin-4-yl)methanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

213.1266 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.13388 147.3
[M+Na]+ 236.11582 155.6
[M-H]- 212.11932 153.4
[M+NH4]+ 231.16042 166.9
[M+K]+ 252.08976 153.3
[M+H-H2O]+ 196.12386 139.2
[M+HCOO]- 258.12480 173.4
[M+CH3COO]- 272.14045 200.0
[M+Na-2H]- 234.10127 155.8
[M]+ 213.12605 149.6
[M]- 213.12715 149.6
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

No patent data available for this compound.