CID 46907956

(4-bromopyridin-2-yl)methanamine

Structural Information

Molecular Formula
C6H7BrN2
SMILES
C1=CN=C(C=C1Br)CN
InChI
InChI=1S/C6H7BrN2/c7-5-1-2-9-6(3-5)4-8/h1-3H,4,8H2
InChIKey
ZIIMDWQEXYZSMZ-UHFFFAOYSA-N
Compound name
(4-bromopyridin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

181
Patents

185.97926 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.98654 130.5
[M+Na]+ 208.96848 134.1
[M+NH4]+ 204.01308 135.8
[M+K]+ 224.94242 133.8
[M-H]- 184.97198 131.6
[M+Na-2H]- 206.95393 135.1
[M]+ 185.97871 130.1
[M]- 185.97981 130.1
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