CID 2780087

(8-bromonaphthalen-1-yl)methanol

Structural Information

Molecular Formula
C11H9BrO
SMILES
C1=CC2=C(C(=C1)CO)C(=CC=C2)Br
InChI
InChI=1S/C11H9BrO/c12-10-6-2-4-8-3-1-5-9(7-13)11(8)10/h1-6,13H,7H2
InChIKey
CBEFAHWSHVJUKE-UHFFFAOYSA-N
Compound name
(8-bromonaphthalen-1-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

53
Patents

235.98367 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.99095 140.4
[M+Na]+ 258.97289 145.9
[M+NH4]+ 254.01749 146.7
[M+K]+ 274.94683 144.3
[M-H]- 234.97639 142.3
[M+Na-2H]- 256.95834 145.3
[M]+ 235.98312 140.7
[M]- 235.98422 140.7
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