CID 339053

84540-61-4

Structural Information

Molecular Formula

C₆H₁₂N₂O

SMILES

CN1CCC(=NO)CC1

InChI

InChI=1S/C6H12N2O/c1-8-4-2-6(7-9)3-5-8/h9H,2-5H2,1H3

InChIKey

PMWKIHOURGCZOJ-UHFFFAOYSA-N

Compound name

N-(1-methylpiperidin-4-ylidene)hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 114
Patents: 128.09496 Da
Monoisotopic Mass: 0.0
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]+	129.102236	126.2
[M+Na]+	151.084178	132.2
[M-H]-	127.087684	128.1
[M+NH4]+	146.128783	146.7
[M+K]+	167.058118	131.6
[M+H-H2O]+	111.092220	120.0
[M+HCOO]-	173.093161	147.6
[M+CH3COO]-	187.108811	172.3
[M+Na-2H]-	149.069626	132.7
[M]+	128.09441142	121.5
[M]-	128.09550858	121.5

Literature stripe

literature stripe

Patent stripe

patents stripe