CID 135604313

N'-(5-bromo-2-hydroxybenzylidene)-4-methylbenzohydrazide

Structural Information

Molecular Formula
C15H13BrN2O2
SMILES
CC1=CC=C(C=C1)C(=O)N/N=C/C2=C(C=CC(=C2)Br)O
InChI
InChI=1S/C15H13BrN2O2/c1-10-2-4-11(5-3-10)15(20)18-17-9-12-8-13(16)6-7-14(12)19/h2-9,19H,1H3,(H,18,20)/b17-9+
InChIKey
KVDIHWYONRZPDN-RQZCQDPDSA-N
Compound name
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-4-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

332.01605 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.02333 166.6
[M+Na]+ 355.00527 176.4
[M-H]- 331.00877 175.7
[M+NH4]+ 350.04987 183.5
[M+K]+ 370.97921 163.9
[M+H-H2O]+ 315.01331 164.0
[M+HCOO]- 377.01425 189.5
[M+CH3COO]- 391.02990 209.1
[M+Na-2H]- 352.99072 172.1
[M]+ 332.01550 184.7
[M]- 332.01660 184.7
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