CID 110354

Tri(methoxymethyl)diphenyl oxide

Structural Information

Molecular Formula
C18H22O4
SMILES
COCC1=CC=CC=C1OC2=CC(=CC(=C2)COC)COC
InChI
InChI=1S/C18H22O4/c1-19-11-14-8-15(12-20-2)10-17(9-14)22-18-7-5-4-6-16(18)13-21-3/h4-10H,11-13H2,1-3H3
InChIKey
WPUATQNTHQQNSV-UHFFFAOYSA-N
Compound name
1,3-bis(methoxymethyl)-5-[2-(methoxymethyl)phenoxy]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.1518 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.15908 170.6
[M+Na]+ 325.14102 177.9
[M-H]- 301.14452 177.3
[M+NH4]+ 320.18562 185.9
[M+K]+ 341.11496 175.6
[M+H-H2O]+ 285.14906 162.2
[M+HCOO]- 347.15000 194.5
[M+CH3COO]- 361.16565 205.6
[M+Na-2H]- 323.12647 174.4
[M]+ 302.15125 178.0
[M]- 302.15235 178.0
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