CID 248109

N,n'-trimethylenediphthalimide

Structural Information

Molecular Formula
C19H14N2O4
SMILES
C1=CC=C2C(=C1)C(=O)N(C2=O)CCCN3C(=O)C4=CC=CC=C4C3=O
InChI
InChI=1S/C19H14N2O4/c22-16-12-6-1-2-7-13(12)17(23)20(16)10-5-11-21-18(24)14-8-3-4-9-15(14)19(21)25/h1-4,6-9H,5,10-11H2
InChIKey
IPPRCFUEIHNCOU-UHFFFAOYSA-N
Compound name
2-[3-(1,3-dioxoisoindol-2-yl)propyl]isoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

11
Patents

334.09537 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.10265 176.9
[M+Na]+ 357.08459 187.6
[M-H]- 333.08809 183.9
[M+NH4]+ 352.12919 193.7
[M+K]+ 373.05853 181.9
[M+H-H2O]+ 317.09263 169.3
[M+HCOO]- 379.09357 196.5
[M+CH3COO]- 393.10922 188.7
[M+Na-2H]- 355.07004 176.4
[M]+ 334.09482 180.2
[M]- 334.09592 180.2
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