CID 109595

68134-35-0

Structural Information

Molecular Formula
C20H24N3
SMILES
CC(=NN(C)C1=CC=CC=C1)C2=[N+](C3=CC=CC=C3C2(C)C)C
InChI
InChI=1S/C20H24N3/c1-15(21-23(5)16-11-7-6-8-12-16)19-20(2,3)17-13-9-10-14-18(17)22(19)4/h6-14H,1-5H3/q+1
InChIKey
XNQQDNXLYRYJRL-UHFFFAOYSA-N
Compound name
N-methyl-N-[1-(1,3,3-trimethylindol-1-ium-2-yl)ethylideneamino]aniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

306.19702 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.20430 176.0
[M+Na]+ 329.18624 183.6
[M-H]- 305.18974 185.6
[M+NH4]+ 324.23084 195.0
[M+K]+ 345.16018 174.4
[M+H-H2O]+ 289.19428 169.8
[M+HCOO]- 351.19522 200.5
[M+CH3COO]- 365.21087 211.1
[M+Na-2H]- 327.17169 181.9
[M]+ 306.19647 177.7
[M]- 306.19757 177.7
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.