CID 82661131

2-amino-2-(6-bromopyridin-2-yl)ethan-1-ol dihydrobromide

Structural Information

Molecular Formula
C7H9BrN2O
SMILES
C1=CC(=NC(=C1)Br)C(CO)N
InChI
InChI=1S/C7H9BrN2O/c8-7-3-1-2-6(10-7)5(9)4-11/h1-3,5,11H,4,9H2
InChIKey
OMGUWDWNWSFKMB-UHFFFAOYSA-N
Compound name
2-amino-2-(6-bromo-2-pyridinyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.98982 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.997096 137.5
[M+Na]+ 238.979038 148.0
[M-H]- 214.982544 140.8
[M+NH4]+ 234.023643 157.2
[M+K]+ 254.952978 136.7
[M+H-H2O]+ 198.987080 136.7
[M+HCOO]- 260.988021 157.0
[M+CH3COO]- 275.003671 184.0
[M+Na-2H]- 236.964486 144.5
[M]+ 215.98927142 153.4
[M]- 215.99036858 153.4
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

No patent data available for this compound.