CID 25986

Acetamide, n-(alpha-(1-methyl-1-piperidinoethyl)benzylidene)-2-phenyl-, hydrochloride

Structural Information

Molecular Formula
C23H28N2O
SMILES
CC(C)(C(=NC(=O)CC1=CC=CC=C1)C2=CC=CC=C2)N3CCCCC3
InChI
InChI=1S/C23H28N2O/c1-23(2,25-16-10-5-11-17-25)22(20-14-8-4-9-15-20)24-21(26)18-19-12-6-3-7-13-19/h3-4,6-9,12-15H,5,10-11,16-18H2,1-2H3
InChIKey
UPHRNCZRYCAXKT-UHFFFAOYSA-N
Compound name
N-(2-methyl-1-phenyl-2-piperidin-1-ylpropylidene)-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.22015 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.22743 186.8
[M+Na]+ 371.20937 187.5
[M-H]- 347.21287 194.1
[M+NH4]+ 366.25397 197.3
[M+K]+ 387.18331 183.0
[M+H-H2O]+ 331.21741 175.9
[M+HCOO]- 393.21835 203.2
[M+CH3COO]- 407.23400 217.0
[M+Na-2H]- 369.19482 188.9
[M]+ 348.21960 181.6
[M]- 348.22070 181.6
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.