CID 2777199

4-(trifluoromethoxy)benzaldehyde oxime

Structural Information

Molecular Formula

C₈H₆F₃NO₂

SMILES

C1=CC(=CC=C1C=NO)OC(F)(F)F

InChI

InChI=1S/C8H6F3NO2/c9-8(10,11)14-7-3-1-6(2-4-7)5-12-13/h1-5,13H

InChIKey

SFLMISFBFTUVTD-UHFFFAOYSA-N

Compound name

N-[[4-(trifluoromethoxy)phenyl]methylidene]hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 109
Patents: 205.03506 Da
Monoisotopic Mass: 3.2
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]+	206.04234	143.1
[M+Na]+	228.02428	151.6
[M+NH4]+	223.06888	148.3
[M+K]+	243.99822	146.8
[M-H]-	204.02778	140.1
[M+Na-2H]-	226.00973	147.5
[M]+	205.03451	143.0
[M]-	205.03561	143.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe