CID 84669813

(1s)-1-(3-bromopyridin-4-yl)ethan-1-amine dihydrochloride

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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.

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No patent data available for this compound.