CID 7526

N-nitrosopiperidine

Structural Information

Molecular Formula
C5H10N2O
SMILES
C1CCN(CC1)N=O
InChI
InChI=1S/C5H10N2O/c8-6-7-4-2-1-3-5-7/h1-5H2
InChIKey
UWSDONTXWQOZFN-UHFFFAOYSA-N
Compound name
1-nitrosopiperidine
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

140
References

1087
Patents

114.079315 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.08659 122.2
[M+Na]+ 137.06853 132.8
[M+NH4]+ 132.11314 131.1
[M+K]+ 153.04247 127.0
[M-H]- 113.07204 124.4
[M+Na-2H]- 135.05398 128.5
[M]+ 114.07877 124.0
[M]- 114.07986 124.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe