CID 138593628

2-(10-bromoanthracen-9-yl)pyridine

Structural Information

Molecular Formula
C19H12BrN
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2Br)C4=CC=CC=N4
InChI
InChI=1S/C19H12BrN/c20-19-15-9-3-1-7-13(15)18(17-11-5-6-12-21-17)14-8-2-4-10-16(14)19/h1-12H
InChIKey
SHULLMURMQNPKV-UHFFFAOYSA-N
Compound name
2-(10-bromoanthracen-9-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

333.01532 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.02260 170.8
[M+Na]+ 356.00454 183.8
[M-H]- 332.00804 180.6
[M+NH4]+ 351.04914 188.9
[M+K]+ 371.97848 170.4
[M+H-H2O]+ 316.01258 168.9
[M+HCOO]- 378.01352 190.4
[M+CH3COO]- 392.02917 184.6
[M+Na-2H]- 353.98999 181.1
[M]+ 333.01477 190.2
[M]- 333.01587 190.2
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