CID 10846996

1h-isoindole-1,3(2h)-dione, 2-(2-cyclopenten-1-yloxy)-

Structural Information

Molecular Formula
C13H11NO3
SMILES
C1CC(C=C1)ON2C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C13H11NO3/c15-12-10-7-3-4-8-11(10)13(16)14(12)17-9-5-1-2-6-9/h1,3-5,7-9H,2,6H2
InChIKey
ZLZXBIRCZUAYTE-UHFFFAOYSA-N
Compound name
2-cyclopent-2-en-1-yloxyisoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

229.0739 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.08118 149.8
[M+Na]+ 252.06312 161.6
[M+NH4]+ 247.10772 158.1
[M+K]+ 268.03706 159.0
[M-H]- 228.06662 152.2
[M+Na-2H]- 250.04857 154.9
[M]+ 229.07335 151.9
[M]- 229.07445 151.9
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

patents stripe