CID 9570113

Benzoyl bromide, 2,4-dibromophenylhydrazone

Structural Information

Molecular Formula
C13H9Br3N2
SMILES
C1=CC=C(C=C1)/C(=N/NC2=C(C=C(C=C2)Br)Br)/Br
InChI
InChI=1S/C13H9Br3N2/c14-10-6-7-12(11(15)8-10)17-18-13(16)9-4-2-1-3-5-9/h1-8,17H/b18-13-
InChIKey
LCAVXBLQYLZLDG-AQTBWJFISA-N
Compound name
(Z)-N-(2,4-dibromophenyl)benzenecarbohydrazonoyl bromide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

429.8316 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 430.83888 158.3
[M+Na]+ 452.82082 164.2
[M-H]- 428.82432 165.5
[M+NH4]+ 447.86542 171.0
[M+K]+ 468.79476 148.6
[M+H-H2O]+ 412.82886 171.2
[M+HCOO]- 474.82980 169.7
[M+CH3COO]- 488.84545 230.4
[M+Na-2H]- 450.80627 162.8
[M]+ 429.83105 197.9
[M]- 429.83215 197.9
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.