CID 6891505

352220-16-7

Structural Information

Molecular Formula

C₉H₁₁NO₂

SMILES

CCOC1=CC=CC=C1/C=N/O

InChI

InChI=1S/C9H11NO2/c1-2-12-9-6-4-3-5-8(9)7-10-11/h3-7,11H,2H2,1H3/b10-7+

InChIKey

WZRKOXBTHOWETA-JXMROGBWSA-N

Compound name

(NE)-N-[(2-ethoxyphenyl)methylidene]hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 165.07898 Da
Monoisotopic Mass: 2.0
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]+	166.086256	132.7
[M+Na]+	188.068198	140.5
[M-H]-	164.071704	136.6
[M+NH4]+	183.112803	153.3
[M+K]+	204.042138	139.0
[M+H-H2O]+	148.076240	126.7
[M+HCOO]-	210.077181	159.0
[M+CH3COO]-	224.092831	179.7
[M+Na-2H]-	186.053646	140.6
[M]+	165.07843142	134.4
[M]-	165.07952858	134.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe