CID 3044742

1,3,5-triazine-2-amine, n,4-dimethyl-6-(methylthio)-

Structural Information

Molecular Formula
C6H10N4S
SMILES
CC1=NC(=NC(=N1)SC)NC
InChI
InChI=1S/C6H10N4S/c1-4-8-5(7-2)10-6(9-4)11-3/h1-3H3,(H,7,8,9,10)
InChIKey
HNCYGGIKTMLOOD-UHFFFAOYSA-N
Compound name
N,4-dimethyl-6-methylsulfanyl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

170.06262 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.069896 133.6
[M+Na]+ 193.051838 143.9
[M-H]- 169.055344 134.1
[M+NH4]+ 188.096443 151.0
[M+K]+ 209.025778 140.9
[M+H-H2O]+ 153.059880 126.2
[M+HCOO]- 215.060821 151.0
[M+CH3COO]- 229.076471 181.4
[M+Na-2H]- 191.037286 138.8
[M]+ 170.06207142 136.0
[M]- 170.06316858 136.0
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