CID 86627845

4,4-difluoro-1-nitrosopiperidine

Structural Information

Molecular Formula
C5H8F2N2O
SMILES
C1CN(CCC1(F)F)N=O
InChI
InChI=1S/C5H8F2N2O/c6-5(7)1-3-9(8-10)4-2-5/h1-4H2
InChIKey
FFEFLYLLIDMFKU-UHFFFAOYSA-N
Compound name
4,4-difluoro-1-nitrosopiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

150.06047 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.06775 125.0
[M+Na]+ 173.04969 132.6
[M-H]- 149.05319 125.8
[M+NH4]+ 168.09429 147.0
[M+K]+ 189.02363 132.6
[M+H-H2O]+ 133.05773 117.4
[M+HCOO]- 195.05867 146.0
[M+CH3COO]- 209.07432 177.7
[M+Na-2H]- 171.03514 132.4
[M]+ 150.05992 119.8
[M]- 150.06102 119.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe