CID 3078862

Brn 3626766

Structural Information

Molecular Formula
C25H32N2O
SMILES
CC1CC(C(CN1CCC2=CC=CC=C2)C)N(C3=CC=CC=C3)C(=O)C(=C)C
InChI
InChI=1S/C25H32N2O/c1-19(2)25(28)27(23-13-9-6-10-14-23)24-17-21(4)26(18-20(24)3)16-15-22-11-7-5-8-12-22/h5-14,20-21,24H,1,15-18H2,2-4H3
InChIKey
HYEDMAZUCWAQCT-UHFFFAOYSA-N
Compound name
N-[2,5-dimethyl-1-(2-phenylethyl)piperidin-4-yl]-2-methyl-N-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

376.25146 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.25874 196.0
[M+Na]+ 399.24068 197.9
[M-H]- 375.24418 203.8
[M+NH4]+ 394.28528 206.1
[M+K]+ 415.21462 193.1
[M+H-H2O]+ 359.24872 185.0
[M+HCOO]- 421.24966 212.3
[M+CH3COO]- 435.26531 227.6
[M+Na-2H]- 397.22613 192.9
[M]+ 376.25091 192.7
[M]- 376.25201 192.7
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.