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

16
Patents

150.06047 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.067746 125.0
[M+Na]+ 173.049688 132.6
[M-H]- 149.053194 125.8
[M+NH4]+ 168.094293 147.0
[M+K]+ 189.023628 132.6
[M+H-H2O]+ 133.057730 117.4
[M+HCOO]- 195.058671 146.0
[M+CH3COO]- 209.074321 177.7
[M+Na-2H]- 171.035136 132.4
[M]+ 150.05992142 119.8
[M]- 150.06101858 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