CID 9589146

121774-43-4

Structural Information

Molecular Formula
C15H18N3
SMILES
CC1=CC=CC=[N+]1/N=C/C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C15H18N3/c1-13-6-4-5-11-18(13)16-12-14-7-9-15(10-8-14)17(2)3/h4-12H,1-3H3/q+1/b16-12+
InChIKey
XDBYABIIPWSLFI-FOWTUZBSSA-N
Compound name
N,N-dimethyl-4-[(E)-(2-methylpyridin-1-ium-1-yl)iminomethyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.15007 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.15735 156.9
[M+Na]+ 263.13929 164.0
[M-H]- 239.14279 165.3
[M+NH4]+ 258.18389 173.7
[M+K]+ 279.11323 155.8
[M+H-H2O]+ 223.14733 150.4
[M+HCOO]- 285.14827 183.5
[M+CH3COO]- 299.16392 197.4
[M+Na-2H]- 261.12474 165.8
[M]+ 240.14952 157.3
[M]- 240.15062 157.3
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.