CID 3077953

136410-22-5

Structural Information

Molecular Formula
C16H19NO3
SMILES
C1CCC(C1)OC2CCC(=O)N2C(=O)C3=CC=CC=C3
InChI
InChI=1S/C16H19NO3/c18-14-10-11-15(20-13-8-4-5-9-13)17(14)16(19)12-6-2-1-3-7-12/h1-3,6-7,13,15H,4-5,8-11H2
InChIKey
HXHAANZEIVUAOS-UHFFFAOYSA-N
Compound name
1-benzoyl-5-cyclopentyloxypyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

273.1365 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.14378 165.4
[M+Na]+ 296.12572 175.0
[M+NH4]+ 291.17032 172.9
[M+K]+ 312.09966 172.7
[M-H]- 272.12922 168.8
[M+Na-2H]- 294.11117 170.6
[M]+ 273.13595 167.4
[M]- 273.13705 167.4
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