CID 660772

4-pyrimidinamine, 2-((1-methylethyl)thio)-n,n,6-trimethyl-

Structural Information

Molecular Formula
C10H17N3S
SMILES
CC1=CC(=NC(=N1)SC(C)C)N(C)C
InChI
InChI=1S/C10H17N3S/c1-7(2)14-10-11-8(3)6-9(12-10)13(4)5/h6-7H,1-5H3
InChIKey
SVGPWEJFRMEERM-UHFFFAOYSA-N
Compound name
N,N,6-trimethyl-2-propan-2-ylsulfanylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

211.11432 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12160 146.3
[M+Na]+ 234.10354 154.5
[M-H]- 210.10704 149.2
[M+NH4]+ 229.14814 164.0
[M+K]+ 250.07748 152.7
[M+H-H2O]+ 194.11158 138.7
[M+HCOO]- 256.11252 163.1
[M+CH3COO]- 270.12817 194.9
[M+Na-2H]- 232.08899 147.9
[M]+ 211.11377 150.4
[M]- 211.11487 150.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.