CID 18919891

1-[(2-aminophenyl)methyl]piperidin-4-ol

Structural Information

Molecular Formula
C12H18N2O
SMILES
C1CN(CCC1O)CC2=CC=CC=C2N
InChI
InChI=1S/C12H18N2O/c13-12-4-2-1-3-10(12)9-14-7-5-11(15)6-8-14/h1-4,11,15H,5-9,13H2
InChIKey
PSQACRYGRXVOCZ-UHFFFAOYSA-N
Compound name
1-[(2-aminophenyl)methyl]piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

206.1419 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.14918 147.7
[M+Na]+ 229.13112 152.7
[M-H]- 205.13462 150.5
[M+NH4]+ 224.17572 163.9
[M+K]+ 245.10506 148.9
[M+H-H2O]+ 189.13916 140.0
[M+HCOO]- 251.14010 166.2
[M+CH3COO]- 265.15575 185.6
[M+Na-2H]- 227.11657 151.3
[M]+ 206.14135 140.9
[M]- 206.14245 140.9
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