CID 45788711

2-(3-pyridinyl)-1,3-thiazol-5-amine hydrochloride

Structural Information

Molecular Formula
C8H7N3S
SMILES
C1=CC(=CN=C1)C2=NC=C(S2)N
InChI
InChI=1S/C8H7N3S/c9-7-5-11-8(12-7)6-2-1-3-10-4-6/h1-5H,9H2
InChIKey
MUNKBMPBTNZCTE-UHFFFAOYSA-N
Compound name
2-pyridin-3-yl-1,3-thiazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

177.03607 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.043346 133.1
[M+Na]+ 200.025288 143.4
[M-H]- 176.028794 137.8
[M+NH4]+ 195.069893 152.7
[M+K]+ 215.999228 139.5
[M+H-H2O]+ 160.033330 125.9
[M+HCOO]- 222.034271 153.2
[M+CH3COO]- 236.049921 147.0
[M+Na-2H]- 198.010736 137.3
[M]+ 177.03552142 133.1
[M]- 177.03661858 133.1
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