CID 165726124

En300-6513336

Structural Information

Molecular Formula
C14H9NO5
SMILES
CC1=CC=C(O1)C(=O)ON2C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C14H9NO5/c1-8-6-7-11(19-8)14(18)20-15-12(16)9-4-2-3-5-10(9)13(15)17/h2-7H,1H3
InChIKey
UZEUDEAVNYHVTP-UHFFFAOYSA-N
Compound name
(1,3-dioxoisoindol-2-yl) 5-methylfuran-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.04807 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.05535 155.6
[M+Na]+ 294.03729 166.2
[M-H]- 270.04079 164.1
[M+NH4]+ 289.08189 174.1
[M+K]+ 310.01123 164.8
[M+H-H2O]+ 254.04533 149.9
[M+HCOO]- 316.04627 178.3
[M+CH3COO]- 330.06192 195.8
[M+Na-2H]- 292.02274 157.7
[M]+ 271.04752 160.9
[M]- 271.04862 160.9
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

No patent data available for this compound.