CID 63961304

6-bromo-n-(2-methoxyethyl)pyridin-2-amine

Structural Information

Molecular Formula
C8H11BrN2O
SMILES
COCCNC1=NC(=CC=C1)Br
InChI
InChI=1S/C8H11BrN2O/c1-12-6-5-10-8-4-2-3-7(9)11-8/h2-4H,5-6H2,1H3,(H,10,11)
InChIKey
XIJCQZWMUQBZDJ-UHFFFAOYSA-N
Compound name
6-bromo-N-(2-methoxyethyl)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

230.00548 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.012756 139.5
[M+Na]+ 252.994698 150.4
[M-H]- 228.998204 144.4
[M+NH4]+ 248.039303 159.7
[M+K]+ 268.968638 139.7
[M+H-H2O]+ 213.002740 138.3
[M+HCOO]- 275.003681 161.7
[M+CH3COO]- 289.019331 189.0
[M+Na-2H]- 250.980146 148.8
[M]+ 230.00493142 159.1
[M]- 230.00602858 159.1
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