CID 110770

Brn 0488088

Structural Information

Molecular Formula
C15H20N2O2
SMILES
COC1=CC=C(C=C1)N2CCC(C2=O)N3CCCC3
InChI
InChI=1S/C15H20N2O2/c1-19-13-6-4-12(5-7-13)17-11-8-14(15(17)18)16-9-2-3-10-16/h4-7,14H,2-3,8-11H2,1H3
InChIKey
TWAYYLLFOQXVJV-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.15247 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.159746 161.0
[M+Na]+ 283.141688 167.0
[M-H]- 259.145194 167.9
[M+NH4]+ 278.186293 178.2
[M+K]+ 299.115628 163.9
[M+H-H2O]+ 243.149730 152.3
[M+HCOO]- 305.150671 180.2
[M+CH3COO]- 319.166321 194.4
[M+Na-2H]- 281.127136 159.2
[M]+ 260.15192142 158.1
[M]- 260.15301858 158.1
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.