CID 75635

2509-26-4

Structural Information

Molecular Formula
C16H18O3
SMILES
COCC1=CC=C(C=C1)OC2=CC=C(C=C2)COC
InChI
InChI=1S/C16H18O3/c1-17-11-13-3-7-15(8-4-13)19-16-9-5-14(6-10-16)12-18-2/h3-10H,11-12H2,1-2H3
InChIKey
BMWBYLGWPWDACF-UHFFFAOYSA-N
Compound name
1-(methoxymethyl)-4-[4-(methoxymethyl)phenoxy]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

308
Patents

258.12558 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.13286 159.1
[M+Na]+ 281.11480 174.1
[M+NH4]+ 276.15940 167.8
[M+K]+ 297.08874 165.7
[M-H]- 257.11830 163.8
[M+Na-2H]- 279.10025 168.6
[M]+ 258.12503 162.7
[M]- 258.12613 162.7
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