CID 16794328

1-(4-aminobenzoyl)piperidin-4-ol

Structural Information

Molecular Formula
C12H16N2O2
SMILES
C1CN(CCC1O)C(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C12H16N2O2/c13-10-3-1-9(2-4-10)12(16)14-7-5-11(15)6-8-14/h1-4,11,15H,5-8,13H2
InChIKey
HSFGGKHCUDVMPP-UHFFFAOYSA-N
Compound name
(4-aminophenyl)-(4-hydroxypiperidin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

58
Patents

220.12119 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.12847 150.1
[M+Na]+ 243.11041 155.1
[M-H]- 219.11391 153.2
[M+NH4]+ 238.15501 165.6
[M+K]+ 259.08435 151.9
[M+H-H2O]+ 203.11845 142.5
[M+HCOO]- 265.11939 168.1
[M+CH3COO]- 279.13504 187.2
[M+Na-2H]- 241.09586 152.6
[M]+ 220.12064 143.4
[M]- 220.12174 143.4
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