CID 3071965

2,5-pyrrolidinedione, 1-cyclohexyl-3-phenyl-

Structural Information

Molecular Formula
C16H19NO2
SMILES
C1CCC(CC1)N2C(=O)CC(C2=O)C3=CC=CC=C3
InChI
InChI=1S/C16H19NO2/c18-15-11-14(12-7-3-1-4-8-12)16(19)17(15)13-9-5-2-6-10-13/h1,3-4,7-8,13-14H,2,5-6,9-11H2
InChIKey
AAQHKLOKUPVTJI-UHFFFAOYSA-N
Compound name
1-cyclohexyl-3-phenylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.14157 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.14885 162.0
[M+Na]+ 280.13079 173.9
[M+NH4]+ 275.17539 170.4
[M+K]+ 296.10473 168.2
[M-H]- 256.13429 166.8
[M+Na-2H]- 278.11624 168.6
[M]+ 257.14102 164.8
[M]- 257.14212 164.8
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.