CID 3046013

Alpha-methyl-n-(2-methyl-4-(phenylmethoxy)phenyl)-1-pyrrolidineacetamide hydrochloride

Structural Information

Molecular Formula
C21H26N2O2
SMILES
CC1=C(C=CC(=C1)OCC2=CC=CC=C2)NC(=O)C(C)N3CCCC3
InChI
InChI=1S/C21H26N2O2/c1-16-14-19(25-15-18-8-4-3-5-9-18)10-11-20(16)22-21(24)17(2)23-12-6-7-13-23/h3-5,8-11,14,17H,6-7,12-13,15H2,1-2H3,(H,22,24)
InChIKey
YMXQTEZUQAAAPP-UHFFFAOYSA-N
Compound name
N-(2-methyl-4-phenylmethoxyphenyl)-2-pyrrolidin-1-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.19943 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.20671 184.4
[M+Na]+ 361.18865 195.6
[M+NH4]+ 356.23325 191.7
[M+K]+ 377.16259 190.2
[M-H]- 337.19215 189.7
[M+Na-2H]- 359.17410 191.8
[M]+ 338.19888 187.3
[M]- 338.19998 187.3
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.