CID 2249224

N,n'-(ethylenedioxy)diphthalimide

Structural Information

Molecular Formula
C18H12N2O6
SMILES
C1=CC=C2C(=C1)C(=O)N(C2=O)OCCON3C(=O)C4=CC=CC=C4C3=O
InChI
InChI=1S/C18H12N2O6/c21-15-11-5-1-2-6-12(11)16(22)19(15)25-9-10-26-20-17(23)13-7-3-4-8-14(13)18(20)24/h1-8H,9-10H2
InChIKey
CDKMESCTNMNHID-UHFFFAOYSA-N
Compound name
2-[2-(1,3-dioxoisoindol-2-yl)oxyethoxy]isoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

352.06955 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.076826 176.6
[M+Na]+ 375.058768 187.0
[M-H]- 351.062274 183.8
[M+NH4]+ 370.103373 192.4
[M+K]+ 391.032708 183.1
[M+H-H2O]+ 335.066810 169.0
[M+HCOO]- 397.067751 196.8
[M+CH3COO]- 411.083401 212.4
[M+Na-2H]- 373.044216 177.3
[M]+ 352.06900142 182.4
[M]- 352.07009858 182.4
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