CID 3678069

3-iodo-9h-carbazole

Structural Information

Molecular Formula
C12H8IN
SMILES
C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)I
InChI
InChI=1S/C12H8IN/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h1-7,14H
InChIKey
OYIGWMXXIFYAGD-UHFFFAOYSA-N
Compound name
3-iodo-9H-carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

311
Patents

292.97015 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.97743 137.6
[M+Na]+ 315.95937 141.7
[M-H]- 291.96287 134.0
[M+NH4]+ 311.00397 154.7
[M+K]+ 331.93331 142.0
[M+H-H2O]+ 275.96741 128.1
[M+HCOO]- 337.96835 155.2
[M+CH3COO]- 351.98400 147.6
[M+Na-2H]- 313.94482 135.2
[M]+ 292.96960 135.3
[M]- 292.97070 135.3
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