CID 42797

Maleimide, n-4-biphenylyl-

Structural Information

Molecular Formula
C16H11NO2
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)N3C(=O)C=CC3=O
InChI
InChI=1S/C16H11NO2/c18-15-10-11-16(19)17(15)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H
InChIKey
RXWKCYQPTDVVSI-UHFFFAOYSA-N
Compound name
1-(4-phenylphenyl)pyrrole-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

39
Patents

249.07898 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.08626 154.2
[M+Na]+ 272.06820 163.5
[M-H]- 248.07170 163.4
[M+NH4]+ 267.11280 171.6
[M+K]+ 288.04214 158.6
[M+H-H2O]+ 232.07624 145.9
[M+HCOO]- 294.07718 178.2
[M+CH3COO]- 308.09283 167.5
[M+Na-2H]- 270.05365 157.8
[M]+ 249.07843 153.9
[M]- 249.07953 153.9
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