CID 1863

Ficz

Structural Information

Molecular Formula
C19H12N2O
SMILES
C1=CC=C2C(=C1)C3=CC4=C(C5=CC=CC=C5N4)C(=C3N2)C=O
InChI
InChI=1S/C19H12N2O/c22-10-14-18-12-6-2-4-8-16(12)20-17(18)9-13-11-5-1-3-7-15(11)21-19(13)14/h1-10,20-21H
InChIKey
ZUDXFBWDXVNRKF-UHFFFAOYSA-N
Compound name
5,11-dihydroindolo[3,2-b]carbazole-12-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

206
References

1106
Patents

284.09497 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.10225 163.0
[M+Na]+ 307.08419 177.2
[M-H]- 283.08769 167.6
[M+NH4]+ 302.12879 183.0
[M+K]+ 323.05813 168.0
[M+H-H2O]+ 267.09223 156.1
[M+HCOO]- 329.09317 183.8
[M+CH3COO]- 343.10882 175.9
[M+Na-2H]- 305.06964 170.5
[M]+ 284.09442 167.1
[M]- 284.09552 167.1
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

patents stripe