CID 203236

2-pyrrolidinone, 1-(p-(2-(1-pyrrolidinyl)ethoxy)phenyl)-

Structural Information

Molecular Formula
C16H22N2O2
SMILES
C1CCN(C1)CCOC2=CC=C(C=C2)N3CCCC3=O
InChI
InChI=1S/C16H22N2O2/c19-16-4-3-11-18(16)14-5-7-15(8-6-14)20-13-12-17-9-1-2-10-17/h5-8H,1-4,9-13H2
InChIKey
ZERNUJININJBQK-UHFFFAOYSA-N
Compound name
1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

274.16812 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.17540 165.4
[M+Na]+ 297.15734 170.0
[M-H]- 273.16084 171.6
[M+NH4]+ 292.20194 181.7
[M+K]+ 313.13128 166.7
[M+H-H2O]+ 257.16538 156.1
[M+HCOO]- 319.16632 184.3
[M+CH3COO]- 333.18197 196.2
[M+Na-2H]- 295.14279 163.7
[M]+ 274.16757 162.4
[M]- 274.16867 162.4
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

patents stripe