CID 15481053

4-[(3-fluorophenyl)methylidene]piperidine hydrochloride

Structural Information

Molecular Formula
C12H14FN
SMILES
C1CNCCC1=CC2=CC(=CC=C2)F
InChI
InChI=1S/C12H14FN/c13-12-3-1-2-11(9-12)8-10-4-6-14-7-5-10/h1-3,8-9,14H,4-7H2
InChIKey
DDIPQUNQCMZFSI-UHFFFAOYSA-N
Compound name
4-[(3-fluorophenyl)methylidene]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

191.11102 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.11830 142.2
[M+Na]+ 214.10024 147.5
[M-H]- 190.10374 143.8
[M+NH4]+ 209.14484 159.3
[M+K]+ 230.07418 142.6
[M+H-H2O]+ 174.10828 133.8
[M+HCOO]- 236.10922 159.2
[M+CH3COO]- 250.12487 179.3
[M+Na-2H]- 212.08569 146.5
[M]+ 191.11047 133.3
[M]- 191.11157 133.3
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