CID 86261406

N'-(5-bromo-2-hydroxybenzylidene)-3-nitrobenzohydrazide

Structural Information

Molecular Formula
C14H10BrN3O4
SMILES
C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N/N=C/C2=C(C=CC(=C2)Br)O
InChI
InChI=1S/C14H10BrN3O4/c15-11-4-5-13(19)10(6-11)8-16-17-14(20)9-2-1-3-12(7-9)18(21)22/h1-8,19H,(H,17,20)/b16-8+
InChIKey
XCSKKESWMADMGR-LZYBPNLTSA-N
Compound name
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-nitrobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.98547 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.99275 170.9
[M+Na]+ 385.97469 178.9
[M-H]- 361.97819 179.7
[M+NH4]+ 381.01929 185.1
[M+K]+ 401.94863 163.2
[M+H-H2O]+ 345.98273 171.5
[M+HCOO]- 407.98367 194.7
[M+CH3COO]- 421.99932 207.1
[M+Na-2H]- 383.96014 178.0
[M]+ 362.98492 187.8
[M]- 362.98602 187.8
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.