CID 138109309

4-chloro-7-methylthieno[3,2-d]pyrimidin-2-amine

Structural Information

Molecular Formula
C7H6ClN3S
SMILES
CC1=CSC2=C1N=C(N=C2Cl)N
InChI
InChI=1S/C7H6ClN3S/c1-3-2-12-5-4(3)10-7(9)11-6(5)8/h2H,1H3,(H2,9,10,11)
InChIKey
FWWFDHSNTIWYKG-UHFFFAOYSA-N
Compound name
4-chloro-7-methylthieno[3,2-d]pyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.9971 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.00438 136.9
[M+Na]+ 221.98632 151.5
[M+NH4]+ 217.03092 146.7
[M+K]+ 237.96026 144.1
[M-H]- 197.98982 139.5
[M+Na-2H]- 219.97177 143.4
[M]+ 198.99655 140.5
[M]- 198.99765 140.5
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.