CID 131143026

2-(6-bromopyridin-3-yl)propan-2-amine

Structural Information

Molecular Formula
C8H11BrN2
SMILES
CC(C)(C1=CN=C(C=C1)Br)N
InChI
InChI=1S/C8H11BrN2/c1-8(2,10)6-3-4-7(9)11-5-6/h3-5H,10H2,1-2H3
InChIKey
BAHCOTFDBYLPFZ-UHFFFAOYSA-N
Compound name
2-(6-bromopyridin-3-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

214.01056 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.01784 139.2
[M+Na]+ 236.99978 150.7
[M-H]- 213.00328 144.0
[M+NH4]+ 232.04438 160.0
[M+K]+ 252.97372 139.4
[M+H-H2O]+ 197.00782 138.9
[M+HCOO]- 259.00876 159.1
[M+CH3COO]- 273.02441 186.8
[M+Na-2H]- 234.98523 147.9
[M]+ 214.01001 156.0
[M]- 214.01111 156.0
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