CID 10858776

1-(4-bromophenyl)-2-phenylethan-1-ol

Structural Information

Molecular Formula
C14H13BrO
SMILES
C1=CC=C(C=C1)CC(C2=CC=C(C=C2)Br)O
InChI
InChI=1S/C14H13BrO/c15-13-8-6-12(7-9-13)14(16)10-11-4-2-1-3-5-11/h1-9,14,16H,10H2
InChIKey
JYLIIPKJJWWRMG-UHFFFAOYSA-N
Compound name
1-(4-bromophenyl)-2-phenylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

276.01498 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.02226 155.9
[M+Na]+ 299.00420 165.5
[M-H]- 275.00770 163.5
[M+NH4]+ 294.04880 174.7
[M+K]+ 314.97814 153.5
[M+H-H2O]+ 259.01224 155.4
[M+HCOO]- 321.01318 175.5
[M+CH3COO]- 335.02883 193.2
[M+Na-2H]- 296.98965 162.2
[M]+ 276.01443 172.9
[M]- 276.01553 172.9
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