CID 6895715

4-bromo-n'-(2-methyl-3-phenyl-2-propenylidene)benzohydrazide

Structural Information

Molecular Formula
C17H15BrN2O
SMILES
C/C(=C/C1=CC=CC=C1)/C=N/NC(=O)C2=CC=C(C=C2)Br
InChI
InChI=1S/C17H15BrN2O/c1-13(11-14-5-3-2-4-6-14)12-19-20-17(21)15-7-9-16(18)10-8-15/h2-12H,1H3,(H,20,21)/b13-11-,19-12+
InChIKey
LJOZANQOUBSLBE-MDWFKHSNSA-N
Compound name
4-bromo-N-[(E)-[(Z)-2-methyl-3-phenylprop-2-enylidene]amino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.03677 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.04405 172.4
[M+Na]+ 365.02599 180.4
[M-H]- 341.02949 181.9
[M+NH4]+ 360.07059 189.0
[M+K]+ 380.99993 167.6
[M+H-H2O]+ 325.03403 169.5
[M+HCOO]- 387.03497 195.2
[M+CH3COO]- 401.05062 212.2
[M+Na-2H]- 363.01144 177.5
[M]+ 342.03622 189.6
[M]- 342.03732 189.6
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.