CID 135684891

3-bromo-4-hydroxy-5-methoxybenzaldehyde phenylhydrazone

Structural Information

Molecular Formula
C14H13BrN2O2
SMILES
COC1=C(C(=CC(=C1)/C=N/NC2=CC=CC=C2)Br)O
InChI
InChI=1S/C14H13BrN2O2/c1-19-13-8-10(7-12(15)14(13)18)9-16-17-11-5-3-2-4-6-11/h2-9,17-18H,1H3/b16-9+
InChIKey
ZUHSGDFHVUZADS-CXUHLZMHSA-N
Compound name
2-bromo-6-methoxy-4-[(E)-(phenylhydrazinylidene)methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.01605 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.02333 162.4
[M+Na]+ 343.00527 172.5
[M-H]- 319.00877 171.5
[M+NH4]+ 338.04987 179.8
[M+K]+ 358.97921 160.4
[M+H-H2O]+ 303.01331 159.8
[M+HCOO]- 365.01425 186.3
[M+CH3COO]- 379.02990 206.8
[M+Na-2H]- 340.99072 169.6
[M]+ 320.01550 181.5
[M]- 320.01660 181.5
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.