CID 11470199

2287333-80-4

Structural Information

Molecular Formula
C12H17NO
SMILES
C1CNCCC1CC2=CC(=CC=C2)O
InChI
InChI=1S/C12H17NO/c14-12-3-1-2-11(9-12)8-10-4-6-13-7-5-10/h1-3,9-10,13-14H,4-8H2
InChIKey
URJVOAQPKQPTIP-UHFFFAOYSA-N
Compound name
3-(piperidin-4-ylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.13101 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.13829 144.0
[M+Na]+ 214.12023 148.4
[M-H]- 190.12373 145.6
[M+NH4]+ 209.16483 160.4
[M+K]+ 230.09417 144.2
[M+H-H2O]+ 174.12827 136.7
[M+HCOO]- 236.12921 160.6
[M+CH3COO]- 250.14486 177.6
[M+Na-2H]- 212.10568 148.5
[M]+ 191.13046 136.6
[M]- 191.13156 136.6
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.