CID 9570593

Brn 1495302

Structural Information

Molecular Formula
C20H16ClN3
SMILES
CN1C2=C(C=C(C=C2)/C=N/NC3=CC=C(C=C3)Cl)C4=CC=CC=C41
InChI
InChI=1S/C20H16ClN3/c1-24-19-5-3-2-4-17(19)18-12-14(6-11-20(18)24)13-22-23-16-9-7-15(21)8-10-16/h2-13,23H,1H3/b22-13+
InChIKey
YSASFNIEQKYWCW-LPYMAVHISA-N
Compound name
4-chloro-N-[(E)-(9-methylcarbazol-3-yl)methylideneamino]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.10327 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.11055 178.4
[M+Na]+ 356.09249 189.6
[M-H]- 332.09599 187.3
[M+NH4]+ 351.13709 195.9
[M+K]+ 372.06643 181.3
[M+H-H2O]+ 316.10053 169.4
[M+HCOO]- 378.10147 200.0
[M+CH3COO]- 392.11712 190.6
[M+Na-2H]- 354.07794 185.1
[M]+ 333.10272 183.3
[M]- 333.10382 183.3
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.