CID 76909

1-bromo-2-naphthaldehyde

Structural Information

Molecular Formula
C11H7BrO
SMILES
C1=CC=C2C(=C1)C=CC(=C2Br)C=O
InChI
InChI=1S/C11H7BrO/c12-11-9(7-13)6-5-8-3-1-2-4-10(8)11/h1-7H
InChIKey
CYGUXEZVBLMVRV-UHFFFAOYSA-N
Compound name
1-bromonaphthalene-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

455
Patents

233.96803 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.97531 138.2
[M+Na]+ 256.95725 144.2
[M+NH4]+ 252.00185 144.6
[M+K]+ 272.93119 142.4
[M-H]- 232.96075 140.3
[M+Na-2H]- 254.94270 143.6
[M]+ 233.96748 138.6
[M]- 233.96858 138.6
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