CID 120169

1-(2-phenoxyethyl)piperidine

Structural Information

Molecular Formula
C13H19NO
SMILES
C1CCN(CC1)CCOC2=CC=CC=C2
InChI
InChI=1S/C13H19NO/c1-3-7-13(8-4-1)15-12-11-14-9-5-2-6-10-14/h1,3-4,7-8H,2,5-6,9-12H2
InChIKey
RSUFKEGMFFPMIB-UHFFFAOYSA-N
Compound name
1-(2-phenoxyethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

311
Patents

205.14667 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.153946 147.6
[M+Na]+ 228.135888 151.4
[M-H]- 204.139394 151.4
[M+NH4]+ 223.180493 164.5
[M+K]+ 244.109828 148.8
[M+H-H2O]+ 188.143930 139.2
[M+HCOO]- 250.144871 166.9
[M+CH3COO]- 264.160521 184.8
[M+Na-2H]- 226.121336 153.2
[M]+ 205.14612142 143.9
[M]- 205.14721858 143.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe