CID 607425

Methyl 4-[(phenoxycarbonyl)oxy]benzoate

Structural Information

Molecular Formula
C15H12O5
SMILES
COC(=O)C1=CC=C(C=C1)OC(=O)OC2=CC=CC=C2
InChI
InChI=1S/C15H12O5/c1-18-14(16)11-7-9-13(10-8-11)20-15(17)19-12-5-3-2-4-6-12/h2-10H,1H3
InChIKey
OFTCZSGUKMVSON-UHFFFAOYSA-N
Compound name
methyl 4-phenoxycarbonyloxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

272.06848 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.075756 158.6
[M+Na]+ 295.057698 165.5
[M-H]- 271.061204 165.5
[M+NH4]+ 290.102303 174.3
[M+K]+ 311.031638 164.3
[M+H-H2O]+ 255.065740 150.7
[M+HCOO]- 317.066681 182.2
[M+CH3COO]- 331.082331 194.6
[M+Na-2H]- 293.043146 163.1
[M]+ 272.06793142 162.7
[M]- 272.06902858 162.7
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