CID 2765097

N-allyloxyphthalimide

Structural Information

Molecular Formula

C₁₁H₉NO₃

SMILES

C=CCON1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C11H9NO3/c1-2-7-15-12-10(13)8-5-3-4-6-9(8)11(12)14/h2-6H,1,7H2

InChIKey

XVKREICBUWCANY-UHFFFAOYSA-N

Compound name

2-prop-2-enoxyisoindole-1,3-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 116
Patents: 203.05824 Da
Monoisotopic Mass: 2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	204.06552	140.1
[M+Na]+	226.04746	150.5
[M-H]-	202.05096	143.9
[M+NH4]+	221.09206	161.1
[M+K]+	242.02140	147.4
[M+H-H2O]+	186.05550	134.2
[M+HCOO]-	248.05644	163.2
[M+CH3COO]-	262.07209	184.7
[M+Na-2H]-	224.03291	145.0
[M]+	203.05769	142.8
[M]-	203.05879	142.8

Literature stripe

literature stripe

Patent stripe

patents stripe