CID 3078132

2-pyrrolidinone, 1-(4-chlorobenzoyl)-

Structural Information

Molecular Formula
C11H10ClNO2
SMILES
C1CC(=O)N(C1)C(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C11H10ClNO2/c12-9-5-3-8(4-6-9)11(15)13-7-1-2-10(13)14/h3-6H,1-2,7H2
InChIKey
HTMAAEZYWDDRFE-UHFFFAOYSA-N
Compound name
1-(4-chlorobenzoyl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.04001 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.04729 146.2
[M+Na]+ 246.02923 159.0
[M+NH4]+ 241.07383 154.5
[M+K]+ 262.00317 154.1
[M-H]- 222.03273 148.6
[M+Na-2H]- 244.01468 152.7
[M]+ 223.03946 148.8
[M]- 223.04056 148.8
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.