CID 11738340

2-(benzyloxy)-4-(bromomethyl)-1-methoxybenzene

Structural Information

Molecular Formula
C15H15BrO2
SMILES
COC1=C(C=C(C=C1)CBr)OCC2=CC=CC=C2
InChI
InChI=1S/C15H15BrO2/c1-17-14-8-7-13(10-16)9-15(14)18-11-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3
InChIKey
JLKLAWVKJNTSAB-UHFFFAOYSA-N
Compound name
4-(bromomethyl)-1-methoxy-2-phenylmethoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

64
Patents

306.02554 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.03282 160.2
[M+Na]+ 329.01476 165.8
[M+NH4]+ 324.05936 165.6
[M+K]+ 344.98870 163.5
[M-H]- 305.01826 163.3
[M+Na-2H]- 327.00021 166.4
[M]+ 306.02499 160.9
[M]- 306.02609 160.9
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