CID 271520

16434-83-6

Structural Information

Molecular Formula

C₁₃H₁₁BrN₂O

SMILES

C1=CC=C(C=C1)NN=CC2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C13H11BrN2O/c14-11-6-7-13(17)10(8-11)9-15-16-12-4-2-1-3-5-12/h1-9,16-17H

InChIKey

CUHVDGAHCMUDKL-UHFFFAOYSA-N

Compound name

4-bromo-2-[(phenylhydrazinylidene)methyl]phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 290.0055 Da
Monoisotopic Mass: 3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	291.012776	155.1
[M+Na]+	312.994718	165.1
[M-H]-	288.998224	164.2
[M+NH4]+	308.039323	173.6
[M+K]+	328.968658	152.5
[M+H-H2O]+	273.002760	153.0
[M+HCOO]-	335.003701	179.3
[M+CH3COO]-	349.019351	200.9
[M+Na-2H]-	310.980166	163.6
[M]+	290.00495142	172.3
[M]-	290.00604858	172.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.