CID 85949641

6716-99-0

Structural Information

Molecular Formula
C11H13FN2O
SMILES
C1CN(CCC1C2=CC=C(C=C2)F)N=O
InChI
InChI=1S/C11H13FN2O/c12-11-3-1-9(2-4-11)10-5-7-14(13-15)8-6-10/h1-4,10H,5-8H2
InChIKey
KKMKYPICWXGGEZ-UHFFFAOYSA-N
Compound name
4-(4-fluorophenyl)-1-nitrosopiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.1012 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.10848 145.9
[M+Na]+ 231.09042 158.0
[M+NH4]+ 226.13502 154.2
[M+K]+ 247.06436 150.7
[M-H]- 207.09392 149.2
[M+Na-2H]- 229.07587 153.6
[M]+ 208.10065 148.4
[M]- 208.10175 148.4
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

No patent data available for this compound.