CID 497727

1h-carbazole-1,4(9h)-dione, 3-bromo-9-(phenylmethyl)-

Structural Information

Molecular Formula
C19H12BrNO2
SMILES
C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2C(=O)C=C(C4=O)Br
InChI
InChI=1S/C19H12BrNO2/c20-14-10-16(22)18-17(19(14)23)13-8-4-5-9-15(13)21(18)11-12-6-2-1-3-7-12/h1-10H,11H2
InChIKey
JWYRXYIZPFXELP-UHFFFAOYSA-N
Compound name
9-benzyl-3-bromocarbazole-1,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.00513 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.01241 178.9
[M+Na]+ 387.99435 193.0
[M-H]- 363.99785 189.4
[M+NH4]+ 383.03895 197.9
[M+K]+ 403.96829 179.9
[M+H-H2O]+ 348.00239 177.6
[M+HCOO]- 410.00333 198.7
[M+CH3COO]- 424.01898 192.9
[M+Na-2H]- 385.97980 184.1
[M]+ 365.00458 200.0
[M]- 365.00568 200.0
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

No patent data available for this compound.