CID 162342393

2248378-18-7

Structural Information

Molecular Formula
C14H13NO5
SMILES
CC1(CCOC1)C(=O)ON2C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C14H13NO5/c1-14(6-7-19-8-14)13(18)20-15-11(16)9-4-2-3-5-10(9)12(15)17/h2-5H,6-8H2,1H3
InChIKey
MEJHIYHHFUCYMH-UHFFFAOYSA-N
Compound name
(1,3-dioxoisoindol-2-yl) 3-methyloxolane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.07938 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.08666 157.8
[M+Na]+ 298.06860 166.4
[M-H]- 274.07210 165.3
[M+NH4]+ 293.11320 177.6
[M+K]+ 314.04254 165.4
[M+H-H2O]+ 258.07664 152.4
[M+HCOO]- 320.07758 177.5
[M+CH3COO]- 334.09323 194.8
[M+Na-2H]- 296.05405 159.9
[M]+ 275.07883 160.0
[M]- 275.07993 160.0
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.