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

55
Patents

318.13684 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.144116 175.4
[M+Na]+ 341.126058 183.2
[M-H]- 317.129564 185.7
[M+NH4]+ 336.170663 190.4
[M+K]+ 357.099998 178.2
[M+H-H2O]+ 301.134100 165.9
[M+HCOO]- 363.135041 199.6
[M+CH3COO]- 377.150691 212.6
[M+Na-2H]- 339.111506 175.9
[M]+ 318.13629142 176.6
[M]- 318.13738858 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