CID 9577362

57619-29-1

Structural Information

Molecular Formula

C₇H₁₀N₂O

SMILES

CN1CC=CC=C1/C=N/O

InChI

InChI=1S/C7H10N2O/c1-9-5-3-2-4-7(9)6-8-10/h2-4,6,10H,5H2,1H3/b8-6+

InChIKey

JRWSSAMKYDVNSM-SOFGYWHQSA-N

Compound name

(NE)-N-[(1-methyl-2H-pyridin-6-yl)methylidene]hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 392
Patents: 138.07932 Da
Monoisotopic Mass: 1.2
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]+	139.08660	126.8
[M+Na]+	161.06854	134.5
[M-H]-	137.07204	129.3
[M+NH4]+	156.11314	147.2
[M+K]+	177.04248	133.1
[M+H-H2O]+	121.07658	120.5
[M+HCOO]-	183.07752	150.8
[M+CH3COO]-	197.09317	174.6
[M+Na-2H]-	159.05399	134.8
[M]+	138.07877	125.4
[M]-	138.07987	125.4

Literature stripe

literature stripe

Patent stripe

patents stripe