CID 5907487

Nsc627398

Structural Information

Molecular Formula
C24H23N3
SMILES
CC1=C(C2=CC=CC=C2N1)CC/C(=N/NC3=CC=CC=C3)/C4=CC=CC=C4
InChI
InChI=1S/C24H23N3/c1-18-21(22-14-8-9-15-24(22)25-18)16-17-23(19-10-4-2-5-11-19)27-26-20-12-6-3-7-13-20/h2-15,25-26H,16-17H2,1H3/b27-23-
InChIKey
FDTIXVAECFPTGE-VYIQYICTSA-N
Compound name
N-[(Z)-[3-(2-methyl-1H-indol-3-yl)-1-phenylpropylidene]amino]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.1892 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.196476 184.8
[M+Na]+ 376.178418 190.7
[M-H]- 352.181924 193.9
[M+NH4]+ 371.223023 197.9
[M+K]+ 392.152358 182.8
[M+H-H2O]+ 336.186460 174.4
[M+HCOO]- 398.187401 208.9
[M+CH3COO]- 412.203051 194.7
[M+Na-2H]- 374.163866 189.8
[M]+ 353.18865142 184.2
[M]- 353.18974858 184.2
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.