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

5
Patents

272.06848 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.07576 158.6
[M+Na]+ 295.05770 165.5
[M-H]- 271.06120 165.5
[M+NH4]+ 290.10230 174.3
[M+K]+ 311.03164 164.3
[M+H-H2O]+ 255.06574 150.7
[M+HCOO]- 317.06668 182.2
[M+CH3COO]- 331.08233 194.6
[M+Na-2H]- 293.04315 163.1
[M]+ 272.06793 162.7
[M]- 272.06903 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