CID 3050353

66267-67-2

Structural Information

Molecular Formula
C14H20O5
SMILES
CCOCCOCCOC(=O)C(C1=CC=CC=C1)O
InChI
InChI=1S/C14H20O5/c1-2-17-8-9-18-10-11-19-14(16)13(15)12-6-4-3-5-7-12/h3-7,13,15H,2,8-11H2,1H3
InChIKey
CJYLPNJTRIHDKM-UHFFFAOYSA-N
Compound name
2-(2-ethoxyethoxy)ethyl 2-hydroxy-2-phenylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.13107 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.138346 162.4
[M+Na]+ 291.120288 166.7
[M-H]- 267.123794 163.7
[M+NH4]+ 286.164893 177.7
[M+K]+ 307.094228 165.8
[M+H-H2O]+ 251.128330 155.3
[M+HCOO]- 313.129271 183.1
[M+CH3COO]- 327.144921 194.0
[M+Na-2H]- 289.105736 165.0
[M]+ 268.13052142 167.4
[M]- 268.13161858 167.4
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.