CID 2825138

55224-94-7

Structural Information

Molecular Formula

C₁₁H₁₂ClNO

SMILES

CC(=CC1=CC=C(C=C1)Cl)C(=NO)C

InChI

InChI=1S/C11H12ClNO/c1-8(9(2)13-14)7-10-3-5-11(12)6-4-10/h3-7,14H,1-2H3

InChIKey

MHTJEUOFLVQMCL-UHFFFAOYSA-N

Compound name

N-[4-(4-chlorophenyl)-3-methylbut-3-en-2-ylidene]hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 15
References: 58
Patents: 209.06075 Da
Monoisotopic Mass: 3.3
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]+	210.06803	145.2
[M+Na]+	232.04997	157.6
[M+NH4]+	227.09457	153.5
[M+K]+	248.02391	150.7
[M-H]-	208.05347	147.4
[M+Na-2H]-	230.03542	151.6
[M]+	209.06020	147.7
[M]-	209.06130	147.7

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.