CID 3046011

1-pyrrolidineacetamide, n-(2-methyl-4-(phenylmethoxy)phenyl)-, monohydrochloride

Structural Information

Molecular Formula
C20H24N2O2
SMILES
CC1=C(C=CC(=C1)OCC2=CC=CC=C2)NC(=O)CN3CCCC3
InChI
InChI=1S/C20H24N2O2/c1-16-13-18(24-15-17-7-3-2-4-8-17)9-10-19(16)21-20(23)14-22-11-5-6-12-22/h2-4,7-10,13H,5-6,11-12,14-15H2,1H3,(H,21,23)
InChIKey
HXGQGKUGZZDTOU-UHFFFAOYSA-N
Compound name
N-(2-methyl-4-phenylmethoxyphenyl)-2-pyrrolidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.18378 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.19106 180.5
[M+Na]+ 347.17300 192.2
[M+NH4]+ 342.21760 188.0
[M+K]+ 363.14694 186.2
[M-H]- 323.17650 185.9
[M+Na-2H]- 345.15845 188.5
[M]+ 324.18323 183.5
[M]- 324.18433 183.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.