CID 26689

14426-42-7

Structural Information

Molecular Formula
C10H11ClO3
SMILES
CCOC(=O)COC1=CC=C(C=C1)Cl
InChI
InChI=1S/C10H11ClO3/c1-2-13-10(12)7-14-9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3
InChIKey
QULRDJFRGVHKLN-UHFFFAOYSA-N
Compound name
ethyl 2-(4-chlorophenoxy)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

118
Patents

214.03967 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.04695 141.9
[M+Na]+ 237.02889 150.7
[M-H]- 213.03239 145.7
[M+NH4]+ 232.07349 161.7
[M+K]+ 253.00283 148.1
[M+H-H2O]+ 197.03693 137.0
[M+HCOO]- 259.03787 161.6
[M+CH3COO]- 273.05352 184.6
[M+Na-2H]- 235.01434 147.4
[M]+ 214.03912 147.6
[M]- 214.04022 147.6
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.