CID 112518

1h-pyrrole-2,5-dione, 1-(4-(2-(4-(dimethylamino)phenyl)ethenyl)phenyl)-

Structural Information

Molecular Formula
C20H18N2O2
SMILES
CN(C)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N3C(=O)C=CC3=O
InChI
InChI=1S/C20H18N2O2/c1-21(2)17-9-5-15(6-10-17)3-4-16-7-11-18(12-8-16)22-19(23)13-14-20(22)24/h3-14H,1-2H3
InChIKey
LMRAUYMGCPFJAH-UHFFFAOYSA-N
Compound name
1-[4-[2-[4-(dimethylamino)phenyl]ethenyl]phenyl]pyrrole-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

318.13684 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.14412 175.4
[M+Na]+ 341.12606 183.2
[M-H]- 317.12956 185.7
[M+NH4]+ 336.17066 190.4
[M+K]+ 357.10000 178.2
[M+H-H2O]+ 301.13410 165.9
[M+HCOO]- 363.13504 199.6
[M+CH3COO]- 377.15069 212.6
[M+Na-2H]- 339.11151 175.9
[M]+ 318.13629 176.6
[M]- 318.13739 176.6
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

patents stripe