CID 28379724

[4-(pyridin-4-yl)-1,3-thiazol-2-yl]methanamine dihydrochloride

Structural Information

Molecular Formula
C9H9N3S
SMILES
C1=CN=CC=C1C2=CSC(=N2)CN
InChI
InChI=1S/C9H9N3S/c10-5-9-12-8(6-13-9)7-1-3-11-4-2-7/h1-4,6H,5,10H2
InChIKey
URVHYFCPQPKWDZ-UHFFFAOYSA-N
Compound name
(4-pyridin-4-yl-1,3-thiazol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.05171 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.05899 138.2
[M+Na]+ 214.04093 151.0
[M+NH4]+ 209.08553 147.4
[M+K]+ 230.01487 144.1
[M-H]- 190.04443 142.2
[M+Na-2H]- 212.02638 146.6
[M]+ 191.05116 141.6
[M]- 191.05226 141.6
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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No literature data available for this compound.

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No patent data available for this compound.