CID 42940264

2-chloro-n-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide

Structural Information

Molecular Formula
C13H15ClN2O2
SMILES
CC(C(=O)NC1=CC(=CC=C1)N2CCCC2=O)Cl
InChI
InChI=1S/C13H15ClN2O2/c1-9(14)13(18)15-10-4-2-5-11(8-10)16-7-3-6-12(16)17/h2,4-5,8-9H,3,6-7H2,1H3,(H,15,18)
InChIKey
AAUUDVSVTXSDCA-UHFFFAOYSA-N
Compound name
2-chloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.0822 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.089476 160.3
[M+Na]+ 289.071418 166.9
[M-H]- 265.074924 165.4
[M+NH4]+ 284.116023 177.5
[M+K]+ 305.045358 162.6
[M+H-H2O]+ 249.079460 153.3
[M+HCOO]- 311.080401 176.8
[M+CH3COO]- 325.096051 196.6
[M+Na-2H]- 287.056866 160.5
[M]+ 266.08165142 159.7
[M]- 266.08274858 159.7
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.