CID 133880

2-(2-methoxyphenoxy)ethyl 2-(acetyloxy)benzoate

Structural Information

Molecular Formula
C18H18O6
SMILES
CC(=O)OC1=CC=CC=C1C(=O)OCCOC2=CC=CC=C2OC
InChI
InChI=1S/C18H18O6/c1-13(19)24-15-8-4-3-7-14(15)18(20)23-12-11-22-17-10-6-5-9-16(17)21-2/h3-10H,11-12H2,1-2H3
InChIKey
FEFLVJLFTWFCOV-UHFFFAOYSA-N
Compound name
2-(2-methoxyphenoxy)ethyl 2-acetyloxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

330.11035 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.11763 174.8
[M+Na]+ 353.09957 187.2
[M+NH4]+ 348.14417 180.5
[M+K]+ 369.07351 181.6
[M-H]- 329.10307 177.0
[M+Na-2H]- 351.08502 181.5
[M]+ 330.10980 177.0
[M]- 330.11090 177.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe