CID 56773843

4-[(phenylamino)methyl]piperidin-4-ol

Structural Information

Molecular Formula
C12H18N2O
SMILES
C1CNCCC1(CNC2=CC=CC=C2)O
InChI
InChI=1S/C12H18N2O/c15-12(6-8-13-9-7-12)10-14-11-4-2-1-3-5-11/h1-5,13-15H,6-10H2
InChIKey
BGZVNEQHXCWLLO-UHFFFAOYSA-N
Compound name
4-(anilinomethyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

206.1419 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.14918 147.5
[M+Na]+ 229.13112 151.1
[M-H]- 205.13462 149.0
[M+NH4]+ 224.17572 164.6
[M+K]+ 245.10506 147.1
[M+H-H2O]+ 189.13916 140.1
[M+HCOO]- 251.14010 165.2
[M+CH3COO]- 265.15575 181.0
[M+Na-2H]- 227.11657 154.2
[M]+ 206.14135 139.4
[M]- 206.14245 139.4
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

No patent data available for this compound.