CID 85949641

4-(4-fluorophenyl)-1-nitrosopiperidine

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]+ 209.108476 143.5
[M+Na]+ 231.090418 150.0
[M-H]- 207.093924 148.4
[M+NH4]+ 226.135023 161.1
[M+K]+ 247.064358 147.6
[M+H-H2O]+ 191.098460 134.3
[M+HCOO]- 253.099401 165.1
[M+CH3COO]- 267.115051 190.2
[M+Na-2H]- 229.075866 149.0
[M]+ 208.10065142 139.2
[M]- 208.10174858 139.2
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