CID 43506431

1-[4-(4-bromophenoxy)phenyl]ethan-1-ol

Structural Information

Molecular Formula
C14H13BrO2
SMILES
CC(C1=CC=C(C=C1)OC2=CC=C(C=C2)Br)O
InChI
InChI=1S/C14H13BrO2/c1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h2-10,16H,1H3
InChIKey
SFJUQOXPLWPNJH-UHFFFAOYSA-N
Compound name
1-[4-(4-bromophenoxy)phenyl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.0099 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.01718 158.3
[M+Na]+ 314.99912 168.6
[M-H]- 291.00262 166.3
[M+NH4]+ 310.04372 176.7
[M+K]+ 330.97306 157.2
[M+H-H2O]+ 275.00716 157.6
[M+HCOO]- 337.00810 178.0
[M+CH3COO]- 351.02375 196.2
[M+Na-2H]- 312.98457 164.0
[M]+ 292.00935 177.1
[M]- 292.01045 177.1
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

No patent data available for this compound.