CID 236487

3,6-dichlorocarbazole

Structural Information

Molecular Formula
C12H7Cl2N
SMILES
C1=CC2=C(C=C1Cl)C3=C(N2)C=CC(=C3)Cl
InChI
InChI=1S/C12H7Cl2N/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6,15H
InChIKey
BIMDTNQPZWJKPL-UHFFFAOYSA-N
Compound name
3,6-dichloro-9H-carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

15
References

370
Patents

234.99556 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.002836 146.4
[M+Na]+ 257.984778 160.0
[M-H]- 233.988284 149.3
[M+NH4]+ 253.029383 168.0
[M+K]+ 273.958718 151.7
[M+H-H2O]+ 217.992820 141.5
[M+HCOO]- 279.993761 159.2
[M+CH3COO]- 294.009411 160.0
[M+Na-2H]- 255.970226 153.3
[M]+ 234.99501142 150.2
[M]- 234.99610858 150.2
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