CID 21069929

(5-chloropyridin-2-yl)methanamine

Structural Information

Molecular Formula
C6H7ClN2
SMILES
C1=CC(=NC=C1Cl)CN
InChI
InChI=1S/C6H7ClN2/c7-5-1-2-6(3-8)9-4-5/h1-2,4H,3,8H2
InChIKey
KQJKUOYVWLBSDN-UHFFFAOYSA-N
Compound name
(5-chloropyridin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

215
Patents

142.02977 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.03705 124.2
[M+Na]+ 165.01899 138.2
[M+NH4]+ 160.06359 133.8
[M+K]+ 180.99293 131.1
[M-H]- 141.02249 127.0
[M+Na-2H]- 163.00444 132.6
[M]+ 142.02922 127.3
[M]- 142.03032 127.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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