CID 215684

36066-49-6

Structural Information

Molecular Formula
C16H23NO3
SMILES
C1CCN(CC1)CCOC(=O)C(CO)C2=CC=CC=C2
InChI
InChI=1S/C16H23NO3/c18-13-15(14-7-3-1-4-8-14)16(19)20-12-11-17-9-5-2-6-10-17/h1,3-4,7-8,15,18H,2,5-6,9-13H2
InChIKey
NKUNZZUYPXZYBM-UHFFFAOYSA-N
Compound name
2-piperidin-1-ylethyl 3-hydroxy-2-phenylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1678 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.17508 167.1
[M+Na]+ 300.15702 168.7
[M-H]- 276.16052 169.1
[M+NH4]+ 295.20162 179.9
[M+K]+ 316.13096 166.1
[M+H-H2O]+ 260.16506 158.3
[M+HCOO]- 322.16600 182.4
[M+CH3COO]- 336.18165 195.4
[M+Na-2H]- 298.14247 168.2
[M]+ 277.16725 163.4
[M]- 277.16835 163.4
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

No patent data available for this compound.