CID 43167840

4-[(3-fluoro-4-methoxyphenyl)methoxy]piperidine hydrochloride

Structural Information

Molecular Formula
C13H18FNO2
SMILES
COC1=C(C=C(C=C1)COC2CCNCC2)F
InChI
InChI=1S/C13H18FNO2/c1-16-13-3-2-10(8-12(13)14)9-17-11-4-6-15-7-5-11/h2-3,8,11,15H,4-7,9H2,1H3
InChIKey
MOGGHAAUYCUQSG-UHFFFAOYSA-N
Compound name
4-[(3-fluoro-4-methoxyphenyl)methoxy]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.13216 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.13944 154.0
[M+Na]+ 262.12138 159.3
[M-H]- 238.12488 155.8
[M+NH4]+ 257.16598 169.4
[M+K]+ 278.09532 155.9
[M+H-H2O]+ 222.12942 145.2
[M+HCOO]- 284.13036 170.9
[M+CH3COO]- 298.14601 189.1
[M+Na-2H]- 260.10683 157.1
[M]+ 239.13161 149.6
[M]- 239.13271 149.6
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.