CID 3049157

Brn 1513905

Structural Information

Molecular Formula
C24H30N2O4
SMILES
CC(=O)C1(CCN(CC1)CC(COC2=CC=C(C=C2)NC(=O)C)O)C3=CC=CC=C3
InChI
InChI=1S/C24H30N2O4/c1-18(27)24(20-6-4-3-5-7-20)12-14-26(15-13-24)16-22(29)17-30-23-10-8-21(9-11-23)25-19(2)28/h3-11,22,29H,12-17H2,1-2H3,(H,25,28)
InChIKey
GCNWZWJZUFPQTR-UHFFFAOYSA-N
Compound name
N-[4-[3-(4-acetyl-4-phenylpiperidin-1-yl)-2-hydroxypropoxy]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

410.22055 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 411.22783 200.6
[M+Na]+ 433.20977 210.5
[M+NH4]+ 428.25437 207.1
[M+K]+ 449.18371 202.8
[M-H]- 409.21327 204.5
[M+Na-2H]- 431.19522 208.0
[M]+ 410.22000 202.9
[M]- 410.22110 202.9
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.