CID 135641592

3-bromo-n'-(2-hydroxybenzylidene)benzohydrazide

Structural Information

Molecular Formula
C14H11BrN2O2
SMILES
C1=CC=C(C(=C1)/C=N/NC(=O)C2=CC(=CC=C2)Br)O
InChI
InChI=1S/C14H11BrN2O2/c15-12-6-3-5-10(8-12)14(19)17-16-9-11-4-1-2-7-13(11)18/h1-9,18H,(H,17,19)/b16-9+
InChIKey
QEXIQGCBAFBJNW-CXUHLZMHSA-N
Compound name
3-bromo-N-[(E)-(2-hydroxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

318.0004 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.00768 162.1
[M+Na]+ 340.98962 171.4
[M-H]- 316.99312 171.0
[M+NH4]+ 336.03422 179.2
[M+K]+ 356.96356 159.2
[M+H-H2O]+ 300.99766 159.6
[M+HCOO]- 362.99860 185.3
[M+CH3COO]- 377.01425 205.1
[M+Na-2H]- 338.97507 168.8
[M]+ 317.99985 179.5
[M]- 318.00095 179.5
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

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