CID 204850

A 1313

Structural Information

Molecular Formula
C23H30N2O2
SMILES
CC1=CC(=CC(=C1NC(=O)CN2CCCCC2)C)OCCC3=CC=CC=C3
InChI
InChI=1S/C23H30N2O2/c1-18-15-21(27-14-11-20-9-5-3-6-10-20)16-19(2)23(18)24-22(26)17-25-12-7-4-8-13-25/h3,5-6,9-10,15-16H,4,7-8,11-14,17H2,1-2H3,(H,24,26)
InChIKey
YRNHLAIQOATMFE-UHFFFAOYSA-N
Compound name
N-[2,6-dimethyl-4-(2-phenylethoxy)phenyl]-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.23074 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.23802 192.1
[M+Na]+ 389.21996 194.6
[M-H]- 365.22346 198.7
[M+NH4]+ 384.26456 202.0
[M+K]+ 405.19390 189.5
[M+H-H2O]+ 349.22800 181.0
[M+HCOO]- 411.22894 209.5
[M+CH3COO]- 425.24459 220.3
[M+Na-2H]- 387.20541 191.9
[M]+ 366.23019 189.5
[M]- 366.23129 189.5
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.