CID 30821

N-(1-methyl-3-pyrrolidinyl)-2-phenoxyacetanilide oxalate (1:1)

Structural Information

Molecular Formula
C19H22N2O2
SMILES
CN1CCC(C1)N(C2=CC=CC=C2)C(=O)COC3=CC=CC=C3
InChI
InChI=1S/C19H22N2O2/c1-20-13-12-17(14-20)21(16-8-4-2-5-9-16)19(22)15-23-18-10-6-3-7-11-18/h2-11,17H,12-15H2,1H3
InChIKey
KMIFKUFOPKKDHI-UHFFFAOYSA-N
Compound name
N-(1-methylpyrrolidin-3-yl)-2-phenoxy-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.16812 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.17540 175.3
[M+Na]+ 333.15734 187.0
[M+NH4]+ 328.20194 183.2
[M+K]+ 349.13128 181.6
[M-H]- 309.16084 181.0
[M+Na-2H]- 331.14279 184.1
[M]+ 310.16757 178.4
[M]- 310.16867 178.4
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.