CID 13863673

18065-04-8

Structural Information

Molecular Formula
C15H16O3
SMILES
COC1=CC=CC=C1OCC(C2=CC=CC=C2)O
InChI
InChI=1S/C15H16O3/c1-17-14-9-5-6-10-15(14)18-11-13(16)12-7-3-2-4-8-12/h2-10,13,16H,11H2,1H3
InChIKey
XLCNFGHEUMUJLW-UHFFFAOYSA-N
Compound name
2-(2-methoxyphenoxy)-1-phenylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

244.10994 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.11722 154.8
[M+Na]+ 267.09916 161.0
[M-H]- 243.10266 160.0
[M+NH4]+ 262.14376 171.1
[M+K]+ 283.07310 158.2
[M+H-H2O]+ 227.10720 147.3
[M+HCOO]- 289.10814 177.0
[M+CH3COO]- 303.12379 190.5
[M+Na-2H]- 265.08461 159.9
[M]+ 244.10939 156.4
[M]- 244.11049 156.4
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