CID 135579348

2-bromo-n'-(3-ethoxy-4-hydroxybenzylidene)benzohydrazide

Structural Information

Molecular Formula
C16H15BrN2O3
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2Br)O
InChI
InChI=1S/C16H15BrN2O3/c1-2-22-15-9-11(7-8-14(15)20)10-18-19-16(21)12-5-3-4-6-13(12)17/h3-10,20H,2H2,1H3,(H,19,21)/b18-10+
InChIKey
ZUZVQTKVXFUXBJ-VCHYOVAHSA-N
Compound name
2-bromo-N-[(E)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.0266 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.03388 173.5
[M+Na]+ 385.01582 182.6
[M-H]- 361.01932 182.3
[M+NH4]+ 380.06042 189.0
[M+K]+ 400.98976 170.5
[M+H-H2O]+ 345.02386 170.3
[M+HCOO]- 407.02480 196.1
[M+CH3COO]- 421.04045 213.9
[M+Na-2H]- 383.00127 178.5
[M]+ 362.02605 193.2
[M]- 362.02715 193.2
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.