CID 209957

Propiophenone, 6'-hydroxy-4'-(2-piperidinoethoxy)-, hydrochloride

Structural Information

Molecular Formula
C16H23NO3
SMILES
CCC(=O)C1=C(C=C(C=C1)OCCN2CCCCC2)O
InChI
InChI=1S/C16H23NO3/c1-2-15(18)14-7-6-13(12-16(14)19)20-11-10-17-8-4-3-5-9-17/h6-7,12,19H,2-5,8-11H2,1H3
InChIKey
VDFFOWNRGHIVOY-UHFFFAOYSA-N
Compound name
1-[2-hydroxy-4-(2-piperidin-1-ylethoxy)phenyl]propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1678 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.17508 167.0
[M+Na]+ 300.15702 178.0
[M+NH4]+ 295.20162 173.8
[M+K]+ 316.13096 171.6
[M-H]- 276.16052 169.2
[M+Na-2H]- 298.14247 172.1
[M]+ 277.16725 168.9
[M]- 277.16835 168.9
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

No patent data available for this compound.