CID 24692747

2-(2,6-difluorophenyl)piperidine

Structural Information

Molecular Formula
C11H13F2N
SMILES
C1CCNC(C1)C2=C(C=CC=C2F)F
InChI
InChI=1S/C11H13F2N/c12-8-4-3-5-9(13)11(8)10-6-1-2-7-14-10/h3-5,10,14H,1-2,6-7H2
InChIKey
ZJSJQCCQDQMOPZ-UHFFFAOYSA-N
Compound name
2-(2,6-difluorophenyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

197.10161 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.10889 141.4
[M+Na]+ 220.09083 147.8
[M-H]- 196.09433 142.2
[M+NH4]+ 215.13543 158.5
[M+K]+ 236.06477 143.3
[M+H-H2O]+ 180.09887 132.4
[M+HCOO]- 242.09981 157.5
[M+CH3COO]- 256.11546 181.7
[M+Na-2H]- 218.07628 145.0
[M]+ 197.10106 132.3
[M]- 197.10216 132.3
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