CID 68378

1,2-bis(2-methoxyphenoxy)ethane

Structural Information

Molecular Formula
C16H18O4
SMILES
COC1=CC=CC=C1OCCOC2=CC=CC=C2OC
InChI
InChI=1S/C16H18O4/c1-17-13-7-3-5-9-15(13)19-11-12-20-16-10-6-4-8-14(16)18-2/h3-10H,11-12H2,1-2H3
InChIKey
BHUCDPRGDNRQQO-UHFFFAOYSA-N
Compound name
1-methoxy-2-[2-(2-methoxyphenoxy)ethoxy]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

78
Patents

274.1205 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.12778 161.6
[M+Na]+ 297.10972 168.9
[M-H]- 273.11322 168.3
[M+NH4]+ 292.15432 177.7
[M+K]+ 313.08366 166.9
[M+H-H2O]+ 257.11776 153.4
[M+HCOO]- 319.11870 186.2
[M+CH3COO]- 333.13435 198.4
[M+Na-2H]- 295.09517 167.2
[M]+ 274.11995 167.9
[M]- 274.12105 167.9
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