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

8
Patents

274.16812 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.175396 165.4
[M+Na]+ 297.157338 170.0
[M-H]- 273.160844 171.6
[M+NH4]+ 292.201943 181.7
[M+K]+ 313.131278 166.7
[M+H-H2O]+ 257.165380 156.1
[M+HCOO]- 319.166321 184.3
[M+CH3COO]- 333.181971 196.2
[M+Na-2H]- 295.142786 163.7
[M]+ 274.16757142 162.4
[M]- 274.16866858 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