CID 82658474

1-(4-bromopyridin-2-yl)ethan-1-aminedihydrobromide

Structural Information

Molecular Formula
C7H9BrN2
SMILES
CC(C1=NC=CC(=C1)Br)N
InChI
InChI=1S/C7H9BrN2/c1-5(9)7-4-6(8)2-3-10-7/h2-5H,9H2,1H3
InChIKey
YHLYGLVEIPFADW-UHFFFAOYSA-N
Compound name
1-(4-bromopyridin-2-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

199.9949 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.00218 133.9
[M+Na]+ 222.98412 137.0
[M+NH4]+ 218.02872 139.0
[M+K]+ 238.95806 137.3
[M-H]- 198.98762 134.8
[M+Na-2H]- 220.96957 138.0
[M]+ 199.99435 133.3
[M]- 199.99545 133.3
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