CID 1472776

4-(3-methylthiophen-2-yl)pyrimidin-2-amine

Structural Information

Molecular Formula
C9H9N3S
SMILES
CC1=C(SC=C1)C2=NC(=NC=C2)N
InChI
InChI=1S/C9H9N3S/c1-6-3-5-13-8(6)7-2-4-11-9(10)12-7/h2-5H,1H3,(H2,10,11,12)
InChIKey
FQQZSGNHBBJFAY-UHFFFAOYSA-N
Compound name
4-(3-methylthiophen-2-yl)pyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.05171 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.05899 138.7
[M+Na]+ 214.04093 151.8
[M+NH4]+ 209.08553 147.8
[M+K]+ 230.01487 145.0
[M-H]- 190.04443 142.7
[M+Na-2H]- 212.02638 146.7
[M]+ 191.05116 142.1
[M]- 191.05226 142.1
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

No patent data available for this compound.