CID 5356505

P-ethylacetophenone oxime

Structural Information

Molecular Formula

C₁₀H₁₃NO

SMILES

CCC1=CC=C(C=C1)/C(=N\O)/C

InChI

InChI=1S/C10H13NO/c1-3-9-4-6-10(7-5-9)8(2)11-12/h4-7,12H,3H2,1-2H3/b11-8-

InChIKey

VECGTLCRIQNAIB-FLIBITNWSA-N

Compound name

(NZ)-N-[1-(4-ethylphenyl)ethylidene]hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 163.09972 Da
Monoisotopic Mass: 2.7
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]+	164.10700	134.8
[M+Na]+	186.08894	141.9
[M-H]-	162.09244	138.6
[M+NH4]+	181.13354	155.4
[M+K]+	202.06288	140.2
[M+H-H2O]+	146.09698	129.0
[M+HCOO]-	208.09792	159.5
[M+CH3COO]-	222.11357	181.6
[M+Na-2H]-	184.07439	140.8
[M]+	163.09917	134.7
[M]-	163.10027	134.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe