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]+ 207.149176 147.7
[M+Na]+ 229.131118 152.7
[M-H]- 205.134624 150.5
[M+NH4]+ 224.175723 163.9
[M+K]+ 245.105058 148.9
[M+H-H2O]+ 189.139160 140.0
[M+HCOO]- 251.140101 166.2
[M+CH3COO]- 265.155751 185.6
[M+Na-2H]- 227.116566 151.3
[M]+ 206.14135142 140.9
[M]- 206.14244858 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