CID 818257

3-amino-5-chloropyridine

Structural Information

Molecular Formula
C5H5ClN2
SMILES
C1=C(C=NC=C1Cl)N
InChI
InChI=1S/C5H5ClN2/c6-4-1-5(7)3-8-2-4/h1-3H,7H2
InChIKey
ZHMASVAJFJFFLS-UHFFFAOYSA-N
Compound name
5-chloropyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

452
Patents

128.01413 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.02141 119.6
[M+Na]+ 151.00335 133.9
[M+NH4]+ 146.04795 129.3
[M+K]+ 166.97729 126.9
[M-H]- 127.00685 122.5
[M+Na-2H]- 148.98880 128.2
[M]+ 128.01358 122.7
[M]- 128.01468 122.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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