CID 504068

Mukonal

Structural Information

Molecular Formula
C13H9NO2
SMILES
C1=CC=C2C(=C1)C3=C(N2)C=C(C(=C3)C=O)O
InChI
InChI=1S/C13H9NO2/c15-7-8-5-10-9-3-1-2-4-11(9)14-12(10)6-13(8)16/h1-7,14,16H
InChIKey
NEAHWGSQUXSRNW-UHFFFAOYSA-N
Compound name
2-hydroxy-9H-carbazole-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

14
Patents

211.06332 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.07060 142.5
[M+Na]+ 234.05254 154.2
[M-H]- 210.05604 145.3
[M+NH4]+ 229.09714 163.1
[M+K]+ 250.02648 148.3
[M+H-H2O]+ 194.06058 136.8
[M+HCOO]- 256.06152 164.0
[M+CH3COO]- 270.07717 156.2
[M+Na-2H]- 232.03799 150.2
[M]+ 211.06277 143.9
[M]- 211.06387 143.9
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