CID 2737434

1-(4-fluoro-2-nitrophenyl)piperidine

Structural Information

Molecular Formula
C11H13FN2O2
SMILES
C1CCN(CC1)C2=C(C=C(C=C2)F)[N+](=O)[O-]
InChI
InChI=1S/C11H13FN2O2/c12-9-4-5-10(11(8-9)14(15)16)13-6-2-1-3-7-13/h4-5,8H,1-3,6-7H2
InChIKey
YSBDMNNCMGUEAL-UHFFFAOYSA-N
Compound name
1-(4-fluoro-2-nitrophenyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

224.0961 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.10338 145.4
[M+Na]+ 247.08532 158.2
[M+NH4]+ 242.12992 153.5
[M+K]+ 263.05926 154.1
[M-H]- 223.08882 149.2
[M+Na-2H]- 245.07077 152.4
[M]+ 224.09555 148.1
[M]- 224.09665 148.1
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