CID 762654

1-benzoylpiperazine

Structural Information

Molecular Formula
C11H14N2O
SMILES
C1CN(CCN1)C(=O)C2=CC=CC=C2
InChI
InChI=1S/C11H14N2O/c14-11(10-4-2-1-3-5-10)13-8-6-12-7-9-13/h1-5,12H,6-9H2
InChIKey
VUNXBQRNMNVUMV-UHFFFAOYSA-N
Compound name
phenyl(piperazin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

12
References

2392
Patents

190.11061 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 143.9
[M+Na]+ 213.09983 156.0
[M+NH4]+ 208.14443 151.9
[M+K]+ 229.07377 149.5
[M-H]- 189.10333 146.3
[M+Na-2H]- 211.08528 151.2
[M]+ 190.11006 146.1
[M]- 190.11116 146.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe