CID 53864161

4-nitrosopiperidine

Structural Information

Molecular Formula

C₅H₁₀N₂O

SMILES

C1CNCCC1N=O

InChI

InChI=1S/C5H10N2O/c8-7-5-1-3-6-4-2-5/h5-6H,1-4H2

InChIKey

GYOBZYGGVLLHBK-UHFFFAOYSA-N

Compound name

4-nitrosopiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 154
Patents: 114.079315 Da
Monoisotopic Mass: -0.3
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]+	115.08659	122.5
[M+Na]+	137.06853	132.6
[M+NH4]+	132.11314	131.0
[M+K]+	153.04247	127.0
[M-H]-	113.07204	124.1
[M+Na-2H]-	135.05398	128.2
[M]+	114.07877	124.0
[M]-	114.07986	124.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe