CID 30483

Acetophenone, 6'-hydroxy-4'-(2-(piperidino)ethoxy)-, hydrochloride

Structural Information

Molecular Formula
C15H21NO3
SMILES
CC(=O)C1=C(C=C(C=C1)OCCN2CCCCC2)O
InChI
InChI=1S/C15H21NO3/c1-12(17)14-6-5-13(11-15(14)18)19-10-9-16-7-3-2-4-8-16/h5-6,11,18H,2-4,7-10H2,1H3
InChIKey
CQANSEIFJJQNDE-UHFFFAOYSA-N
Compound name
1-[2-hydroxy-4-(2-piperidin-1-ylethoxy)phenyl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.15213 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.159406 161.9
[M+Na]+ 286.141348 166.2
[M-H]- 262.144854 164.9
[M+NH4]+ 281.185953 176.1
[M+K]+ 302.115288 163.3
[M+H-H2O]+ 246.149390 153.7
[M+HCOO]- 308.150331 178.6
[M+CH3COO]- 322.165981 194.6
[M+Na-2H]- 284.126796 163.4
[M]+ 263.15158142 159.5
[M]- 263.15267858 159.5
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.