CID 141716863

3,11-dibromo-7h-dibenzo[c,g]carbazole

Structural Information

Molecular Formula
C20H11Br2N
SMILES
C1=CC2=C(C=CC3=C2C4=C(N3)C=CC5=C4C=CC(=C5)Br)C=C1Br
InChI
InChI=1S/C20H11Br2N/c21-13-3-5-15-11(9-13)1-7-17-19(15)20-16-6-4-14(22)10-12(16)2-8-18(20)23-17/h1-10,23H
InChIKey
UDZSFBVXXLHMTQ-UHFFFAOYSA-N
Compound name
6,18-dibromo-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

422.9258 Da
Monoisotopic Mass

7.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.93308 177.3
[M+Na]+ 445.91502 190.2
[M-H]- 421.91852 185.7
[M+NH4]+ 440.95962 195.6
[M+K]+ 461.88896 174.7
[M+H-H2O]+ 405.92306 185.5
[M+HCOO]- 467.92400 190.6
[M+CH3COO]- 481.93965 189.8
[M+Na-2H]- 443.90047 184.7
[M]+ 422.92525 212.4
[M]- 422.92635 212.4
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

patents stripe