CID 59869315

(4-bromonaphthalen-2-yl)methanol

Structural Information

Molecular Formula
C11H9BrO
SMILES
C1=CC=C2C(=C1)C=C(C=C2Br)CO
InChI
InChI=1S/C11H9BrO/c12-11-6-8(7-13)5-9-3-1-2-4-10(9)11/h1-6,13H,7H2
InChIKey
VYSCKPUODPPSJS-UHFFFAOYSA-N
Compound name
(4-bromonaphthalen-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
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

No literature data available for this compound.

Patent stripe

patents stripe