CID 11425518

(2-bromophenyl)(phenyl)methanol

Structural Information

Molecular Formula
C13H11BrO
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2Br)O
InChI
InChI=1S/C13H11BrO/c14-12-9-5-4-8-11(12)13(15)10-6-2-1-3-7-10/h1-9,13,15H
InChIKey
PFNIDHUYBLYJGE-UHFFFAOYSA-N
Compound name
(2-bromophenyl)-phenylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

261.99933 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.006606 151.2
[M+Na]+ 284.988548 161.2
[M-H]- 260.992054 159.0
[M+NH4]+ 280.033153 170.6
[M+K]+ 300.962488 149.5
[M+H-H2O]+ 244.996590 151.0
[M+HCOO]- 306.997531 171.1
[M+CH3COO]- 321.013181 190.4
[M+Na-2H]- 282.973996 158.1
[M]+ 261.99878142 168.0
[M]- 261.99987858 168.0
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